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3-(Formylmethyl)cyclohexan-1-one
SpectraBase Compound ID 2IsRAXpkRpv
InChI InChI=1S/C8H12O2/c9-5-4-7-2-1-3-8(10)6-7/h5,7H,1-4,6H2
InChIKey BTYIAQWUKQVHMQ-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nkyO72BGg1
Name 3-(Formylmethyl)cyclohexan-1-one
Alternate Name(s) (3-Oxocyclohexyl)acetaldehyde (3'-Oxocyclohexyl)acetaldehyde 2-(3-Oxocyclohexyl)acetaldehyde 2-(3-Oxidanylidenecyclohexyl)ethanal
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Formula C8H12O2
InChI InChI=1S/C8H12O2/c9-5-4-7-2-1-3-8(10)6-7/h5,7H,1-4,6H2
InChIKey BTYIAQWUKQVHMQ-UHFFFAOYSA-N
Molecular Weight 140.182 g/mol
SMILES C1(=O)CC(CC=O)CCC1
SPLASH splash10-00ry-9300000000-67503d49ee53efa5cac7
Source of Spectrum F-51-5030-12
Wiley ID 791757