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Cyclohexanone, 2-hydroxy-4-methyl-2-(2-oxopropyl)-, (2S-cis)-
SpectraBase Compound ID 99YMMf3AaJv
InChI InChI=1S/C10H16O3/c1-7-3-4-9(12)10(13,5-7)6-8(2)11/h7,13H,3-6H2,1-2H3/t7-,10+/m1/s1
InChIKey UIOILYPXVVPALK-XCBNKYQSSA-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 E0G9IKwfHhN
Name Cyclohexanone, 2-hydroxy-4-methyl-2-(2-oxopropyl)-, (2S-cis)-
CAS Registry Number 112197-58-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-7-3-4-9(12)10(13,5-7)6-8(2)11/h7,13H,3-6H2,1-2H3/t7-,10+/m1/s1
InChIKey UIOILYPXVVPALK-XCBNKYQSSA-N
Molecular Weight 184.235 g/mol
SMILES O[C@]1(C(=O)CC[C@](C1)(C)[H])CC(=O)C
SPLASH splash10-0006-9100000000-44116a4e021cb32925c2
Source of Spectrum J-53-1015-8
Synonyms (-)-(2S,4R)-2-hydroxy-2-(2-oxoprop-1-yl)-4-methylcyclohexanone (2S,4R)-2-hydroxy-4-methyl-2-(2-oxopropyl)cyclohexanone
Wiley ID 1180629