CAS: 7255-28-9 Molecular Formula: C6O6 Molecular Weight (g/mol): 168.06 MDL Number: MFCD00001652,MFCD00149074 InChI Key: PKRGYJHUXHCUCN-UHFFFAOYSA-N Synonym: cyclohexane-hexone, octahydrate, hexaoxocyclohexaneoctahydrate, hexaoxocyclohexane, trichinoyl, unii-7zr8062lfd, hexaketocyclohexane, cyclohexanehexaone, cyclohexane-1,2,3,4,5,6-hexaone, triquinoyl, cyclohexanehexone PubChem CID: 68240 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexone SMILES: O=C1C(=O)C(=O)C(=O)C(=O)C1=O

CAS: 2051-95-8 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00002792 InChI Key: KMQLIDDEQAJAGJ-UHFFFAOYSA-N Synonym: 4-phenyl-4-oxobutyric acid, propionic acid, 3-benzoyl, 3-benzoylpropionicacid, benzenebutanoic acid, .gamma.-oxo, propanoic acid, 3-benzoyl, benzoylpropionic acid, beta-benzoylpropionic acid, 3-benzoylpropanoic acid, 4-oxo-4-phenylbutyric acid, 3-benzoylpropionic acid PubChem CID: 72871 ChEBI: CHEBI:64437 IUPAC Name: 4-oxo-4-phenylbutanoic acid SMILES: OC(=O)CCC(=O)C1=CC=CC=C1

CAS: 90-02-8 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.12 MDL Number: MFCD00003317 InChI Key: SMQUZDBALVYZAC-UHFFFAOYSA-N Synonym: benzaldehyde, o-hydroxy, 2-hydroxy-benzaldehyde, salicyladehyde, salicylic aldehyde, benzaldehyde, 2-hydroxy, 2-formylphenol, salicylal, o-formylphenol, o-hydroxybenzaldehyde, salicylaldehyde PubChem CID: 6998 ChEBI: CHEBI:16008 IUPAC Name: 2-hydroxybenzaldehyde SMILES: OC1=CC=CC=C1C=O

CAS: 78-84-2 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00006980 InChI Key: AMIMRNSIRUDHCM-UHFFFAOYSA-N Synonym: isobutaldehyde, 2-methyl-1-propanal, isopropylaldehyde, valine aldehyde, isobutyric aldehyde, 2-methylpropionaldehyde, propanal, 2-methyl, isobutylaldehyde, isobutanal, isobutyraldehyde PubChem CID: 6561 ChEBI: CHEBI:48943 IUPAC Name: 2-methylpropanal SMILES: CC(C)C=O

CAS: 620-02-0 Molecular Formula: C₆H₆O₂ Molecular Weight (g/mol): 110.11 MDL Number: MFCD00003232 InChI Key: OUDFNZMQXZILJD-UHFFFAOYSA-N Synonym: 2-formyl-5-methylfuran, 2-furaldehyde, 5-methyl, 5-methylfurfuraldehyde, 5-methyl-2-furancarboxaldehyde, 5-methylfuran-2-al, 2-furancarboxaldehyde, 5-methyl, 5-methyl-2-furfural, 5-methyl furfural, 5-methyl-2-furaldehyde, 5-methylfurfural PubChem CID: 12097 ChEBI: CHEBI:2091 IUPAC Name: 5-methylfuran-2-carbaldehyde SMILES: CC1=CC=C(O1)C=O

CAS: 111-30-8 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00007025 InChI Key: SXRSQZLOMIGNAQ-UHFFFAOYSA-N Synonym: glutaric aldehyde, aldesan, glutarol, sonacide, 1,5-pentanedial, glutardialdehyde, cidex, glutaric dialdehyde, glutaral, glutaraldehyde PubChem CID: 3485 ChEBI: CHEBI:64276 IUPAC Name: pentanedial SMILES: O=CCCCC=O

CAS: 66-25-1 Molecular Formula: C₆H₁₂O Molecular Weight (g/mol): 100.16 MDL Number: MFCD00007027 InChI Key: JARKCYVAAOWBJS-UHFFFAOYSA-N Synonym: aldehyde c-6, hexylaldehyde, n-caproaldehyde, hexanaldehyde, n-hexanal, 1-hexanal, capronaldehyde, caproic aldehyde, hexaldehyde, caproaldehyde PubChem CID: 6184 IUPAC Name: hexanal SMILES: CCCCCC=O

CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: 3-methoxy-4-hydroxybenzaldehyde, 4-hydroxy-m-anisaldehyde, lioxin, vanilline, 2-methoxy-4-formylphenol, p-vanillin, vanilla, vanillic aldehyde, vanillaldehyde, vanillin PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O

CAS: 14284-93-6 Molecular Formula: C15H21O6Ru Molecular Weight (g/mol): 398.40 MDL Number: MFCD00000030 InChI Key: RTZYCRSRNSTRGC-LNTINUHCSA-K Synonym: z-4-oxopent-2-en-2-olate; ruthenium 3+, ruthenium, tris 2,4-pentanedionato-8ci, ruthenium, tris 2,4-pentanedionato-kappao,kappao'-, oc-6-11, ruthenium, tris 2,4-pentanedionato-o,o'-, oc-6-11, tris pentane-2,4-dionato-o,o' ruthenium, tris 2,4-pentanedionato ruthenium iii, acetylacetone ruthenium iii salt, ruthenium iii acetylacetonate, ruthenium acetylacetonate PubChem CID: 5488829 SMILES: [Ru+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O

CAS: 67-47-0 Molecular Formula: C₆H₆O₃ Molecular Weight (g/mol): 126.11 InChI Key: NOEGNKMFWQHSLB-UHFFFAOYSA-N Synonym: hydroxymethylfurfurole, 5-hydroxymethylfuraldehyde, 5-oxymethylfurfurole, 5-hydroxymethyl-2-furfural, hydroxymethylfurfural, 5-hydroxymethyl furan-2-carbaldehyde, 5-hydroxymethyl furfural, 5-hydroxymethyl-2-furaldehyde, 5-hydroxymethylfurfural PubChem CID: 237332 ChEBI: CHEBI:412516 IUPAC Name: 5-(hydroxymethyl)furan-2-carbaldehyde SMILES: C1=C(OC(=C1)C=O)CO

CAS: 38861-78-8 Molecular Formula: C₁₂H₁₆O Molecular Weight (g/mol): 176.26 InChI Key: KEAGRYYGYWZVPC-UHFFFAOYSA-N Synonym: unii-aml715rd20, 1-4-2-methylpropyl phenyl ethanone, acetophenone, 4-isobutyl, 1-4-2-methylpropyl phenyl ethan-1-one, ethanone, 1-4-2-methylpropyl phenyl, p-isobutylacetophenone, 1-4-isobutylphenyl ethanone, p-iso-butylacetophenone, 4-isobutylacetophenone, 4'-isobutylacetophenone PubChem CID: 93214 IUPAC Name: 1-[4-(2-methylpropyl)phenyl]ethanone SMILES: CC(C)CC1=CC=C(C=C1)C(=O)C

CAS: 303-98-0 Molecular Formula: C59H90O4 Molecular Weight (g/mol): 863.37 MDL Number: MFCD00042919 InChI Key: ACTIUHUUMQJHFO-UPTCCGCDSA-N Synonym: emitolon, neuquinone, justquinon, ubiquinone, neuquinon, ubiquinone-10, coq10, ubiquinone 50, ubidecarenone, coenzyme q10 PubChem CID: 5281915 ChEBI: CHEBI:46245 SMILES: COC1=C(OC)C(=O)C(C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)=C(C)C1=O

CAS: 1192-62-7 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00003242 InChI Key: IEMMBWWQXVXBEU-UHFFFAOYSA-N Synonym: ethanone, 1-2-furanyl, ketone, 2-furyl methyl, 2-acetyl furan, 2-furylethanone, 1-2-furyl ethanone, methyl 2-furyl ketone, 2-furyl methyl ketone, 1-furan-2-yl ethanone, acetylfuran, 2-acetylfuran PubChem CID: 14505 ChEBI: CHEBI:59983 IUPAC Name: 1-(furan-2-yl)ethanone SMILES: CC(=O)C1=CC=CO1

CAS: 142617-53-6 Molecular Formula: C33H57BiO6 Molecular Weight (g/mol): 758.793 MDL Number: MFCD00064763 InChI Key: ZNHBPQSSVCRFST-LWTKGLMZSA-K Synonym: 4z-5-bis 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy bismuthanyl oxy-2,2,6,6-tetramethylhept-4-en-3-one, bismuth iii tetramethylheptanedionate, tris 2,2,6,6-tetramethyl-3,5-heptanedionato bismuth iii PubChem CID: 16717622 IUPAC Name: (Z)-5-bis[[(Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl]oxy]bismuthanyloxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O[Bi](OC(=CC(=O)C(C)(C)C)C(C)(C)C)OC(=CC(=O)C(C)(C)C)C(C)(C)C

CAS: 930-68-7 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.13 MDL Number: MFCD00001577 InChI Key: FWFSEYBSWVRWGL-UHFFFAOYSA-N Synonym: 2-cyclohexene-1-one, 2-cyclohexenone-1, cyclohexen-1-one, cyclohexen-3-one, 1-cyclohexen-3-one, 3-oxocyclohexene, cyclohexenone, 2-cyclohexenone, cyclohex-2-enone, 2-cyclohexen-1-one PubChem CID: 13594 ChEBI: CHEBI:15977 IUPAC Name: cyclohex-2-en-1-one SMILES: O=C1CCCC=C1

CAS: 1191-95-3 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.09 MDL Number: MFCD00001332 InChI Key: SHQSVMDWKBRBGB-UHFFFAOYSA-N Synonym: pubchem9021, cyclobutanone, 1-oxocyclobutane, 3-cyclobutanone, cylobutanone, cylcobutanone, cyclobutanon, cyclobutanone, 98+%, cyclobutyloxy, unii-6pf2sh405u PubChem CID: 14496 IUPAC Name: cyclobutanone SMILES: O=C1CCC1

CAS: 141-97-9 Molecular Formula: C₆H₁₀O₃ Molecular Weight (g/mol): 130.14 MDL Number: MFCD00009199 InChI Key: XYIBRDXRRQCHLP-UHFFFAOYSA-N Synonym: active acetylacetate, 3-oxo-butyric acid ethyl ester, 3-oxobutanoic acid ethyl ester, acetoacetic acid, ethyl ester, ethyl acetylacetonate, butanoic acid, 3-oxo-, ethyl ester, diacetic ether, ethyl 3-oxobutyrate, ethyl acetylacetate, ethyl acetoacetate PubChem CID: 8868 ChEBI: CHEBI:4893 IUPAC Name: ethyl 3-oxobutanoate SMILES: CCOC(=O)CC(=O)C

CAS: 116-09-6 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00004669 InChI Key: XLSMFKSTNGKWQX-UHFFFAOYSA-N Synonym: 2-oxopropanol, acetylcarbinol, acetylmethanol, methanol, acetyl, 1-hydroxyacetone, 2-propanone, 1-hydroxy, 1-hydroxy-2-propanone, acetone alcohol, acetol, hydroxyacetone PubChem CID: 8299 ChEBI: CHEBI:27957 IUPAC Name: 1-hydroxypropan-2-one SMILES: CC(=O)CO

CAS: 22202-68-2 Molecular Formula: C₅H₅NaO₅ Molecular Weight (g/mol): 168.08 InChI Key: MOTOGHHLNTXPTI-UHFFFAOYSA-M Synonym: sodium 4-carboxy-4-oxobutanoate, 2-oxoglutaric acid 1-sodium salt, alpha-ketoglutaric acid, sodium salt, glutaric acid, 2-oxo-, sodium salt, 2-oxoglutaric acid, sodium salt, 2-ketoglutaric acid monosodium salt, pentanedioic acid, 2-oxo-, sodium salt 1:?, pentanedioic acid, 2-oxo-, sodium salt, sodium hydrogen 2-oxoglutarate PubChem CID: 23672314 IUPAC Name: sodium;5-hydroxy-4,5-dioxopentanoate SMILES: C(CC(=O)[O-])C(=O)C(=O)O.[Na+]

CAS: 121-32-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00006944 InChI Key: CBOQJANXLMLOSS-UHFFFAOYSA-N Synonym: vanillal, quantrovanil, vanilal, vanirom, ethovan, ethavan, ethylprotal, bourbonal, ethylvanillin, ethyl vanillin PubChem CID: 8467 ChEBI: CHEBI:48408 IUPAC Name: 3-ethoxy-4-hydroxybenzaldehyde SMILES: CCOC1=CC(C=O)=CC=C1O

CAS: 3264-82-2 Molecular Formula: C10H14NiO4 Molecular Weight (g/mol): 256.91 MDL Number: MFCD00000024 InChI Key: BMGNSKKZFQMGDH-FDGPNNRMSA-L Synonym: bis 2,4-pentanedionato nickel ii, acetylacetone nickel ii salt, bis 2,4-pentanedionato nickel ii hydrate, nickel ii acetylacetonate PubChem CID: 53384569 SMILES: [Ni++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O

CAS: 98-86-2 MDL Number: MFCD00008724 InChI Key: KWOLFJPFCHCOCG-UHFFFAOYSA-N Synonym: acetylbenzol, 1-phenylethan-1-one, acetophenon, benzoyl methide, hypnone, ethanone, 1-phenyl, phenyl methyl ketone, acetylbenzene, methyl phenyl ketone, acetophenone PubChem CID: 7410 ChEBI: CHEBI:27632 IUPAC Name: 1-phenylethanone SMILES: CC(=O)C1=CC=CC=C1

CAS: 127-17-3 Molecular Formula: C3H4O3 Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: 2-oxopropansaeure, 2-oxo-propionic acid, propanoic acid, 2-oxo, 2-oxopropanoate, 2-ketopropionic acid, alpha-ketopropionic acid, acetylformic acid, 2-oxopropionic acid, pyroracemic acid, pyruvic acid PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(O)=O

CAS: 3264-82-2 Molecular Formula: C10H14NiO4 Molecular Weight (g/mol): 256.91 MDL Number: MFCD00000024 InChI Key: BMGNSKKZFQMGDH-FDGPNNRMSA-L Synonym: bis 2,4-pentanedionato nickel ii, acetylacetone nickel ii salt, bis 2,4-pentanedionato nickel ii hydrate, nickel ii acetylacetonate PubChem CID: 53384569 IUPAC Name: nickel(2+);(E)-4-oxopent-2-en-2-olate SMILES: [Ni++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O

CAS: 23302-83-2 Molecular Formula: C14H13NO Molecular Weight (g/mol): 211.26 MDL Number: MFCD00010099 InChI Key: DBOHWMPKJCJANT-UHFFFAOYSA-N Synonym: 4-2-1-methyl-4-pyridylidene ethylidene cyclohexa-2,5-dien-1-one, 4-2-1-methylpyridin-4-ylidene ethylidene cyclohexa-2,5-die, 1-methyl-4-e-4-oxylatostyryl pyridinium, 1-methyl-4-4-oxylatostyryl pyridinium, brooker/'s merocyanine, 2,5-cyclohexadien-1-one,4-2-1-methyl-4 1h-pyridinylidene ethylidene, 4-2-1-methylpyridin-4-ylidene ethylidene cyclohexa-2,5-dien-1-one, 4-2-1-methylpyridin-4 1h-ylidene ethylidene cyclohexa-2,5-dien-1-one, brooker's merocyanine PubChem CID: 258436 IUPAC Name: 4-[2-(1-methylpyridin-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-one SMILES: CN1C=CC(=CC=C2C=CC(=O)C=C2)C=C1

CAS: 75-07-0 Molecular Formula: C₂H₄O Molecular Weight (g/mol): 44.04 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: aldehyde acetique, octowy aldehyd, aldeide acetica, acetic ethanol, aldehyde, acetylaldehyde, acetaldehyd, ethyl aldehyde, acetic aldehyde, ethanal PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O