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(1S,2R)-2-methyl-1-cyclohexanecarboxylic acid
SpectraBase Compound ID 6OI5yAgNFCE
InChI InChI=1S/C8H14O2/c1-6-4-2-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7+/m1/s1
InChIKey VSKXJRZPVDLHFY-RQJHMYQMSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7XJ92dAflY
Name (1S,2R)-2-methyl-1-cyclohexanecarboxylic acid
CAS Registry Number 121651-45-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-6-4-2-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7+/m1/s1
InChIKey VSKXJRZPVDLHFY-RQJHMYQMSA-N
Molecular Weight 142.198 g/mol
SMILES OC([C@@]1([C@](C)(CCCC1)[H])[H])=O
SPLASH splash10-05gi-9200000000-093685c0c33d245f78cc
Source of Spectrum F-45-486-15
Synonyms (1S,2R)-2-methylcyclohexane-1-carboxylic acid (1S,2R)-2-methylcyclohexanecarboxylic acid
Wiley ID 1141201