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cis-1-ethynyl-2-methylcyclohexanol
SpectraBase Compound ID EEtLeNvriLL
InChI InChI=1S/C9H14O/c1-3-9(10)7-5-4-6-8(9)2/h1,8,10H,4-7H2,2H3/t8-,9+/m1/s1
InChIKey PMCQAVDMFZFUEH-BDAKNGLRSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VNwDiMfSLj
Name cis-1-ethynyl-2-methylcyclohexanol
Alternate Name(s) (1S,2R)-1-ethynyl-2-methylcyclohexan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-3-9(10)7-5-4-6-8(9)2/h1,8,10H,4-7H2,2H3/t8-,9+/m1/s1
InChIKey PMCQAVDMFZFUEH-BDAKNGLRSA-N
Literature Reference DOI 10.1021/acs.orglett.5b01219
Molecular Weight 138.210 g/mol
SMILES O[C@]1(CCCC[C@]1(C)[H])C#C
SPLASH splash10-015b-9200000000-f4ff7784462cd87b752e
Source of Spectrum A1-17-2808/SM6-cis_2b
Wiley ID 1807049