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2-Methyl-5-(1-hydroxycarbonylethyl)-cyclohexanone
SpectraBase Compound ID AWAm1K9P4Cu
InChI InChI=1S/C10H16O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h6-8H,3-5H2,1-2H3,(H,12,13)
InChIKey BZAOKFMENAKEKK-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXbOiwphqdx
Name 2-Methyl-5-(1-hydroxycarbonylethyl)-cyclohexanone
Alternate Name(s) 2-(4-Methyl-3-oxocyclohexyl)propanoic acid
CAS Registry Number 122999-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h6-8H,3-5H2,1-2H3,(H,12,13)
InChIKey BZAOKFMENAKEKK-UHFFFAOYSA-N
Molecular Weight 184.235 g/mol
SMILES OC(C(C1CC(=O)C(CC1)C)C)=O
SPLASH splash10-03di-4900000000-01a35f0cda12e33ab989
Source of Spectrum C-111-8234-0
Wiley ID 1180605