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Cyclohexanol, 1-ethynyl-2-methyl-, trans-
SpectraBase Compound ID 32buMJuZbEo
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-RKDXNWHRSA-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 ATaPXLfhVVZ
Name trans-1-ethynyl-2-methylcyclohexanol
Alternate Name(s) (1R,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-RKDXNWHRSA-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 splash10-00l2-9200000000-d8cc19cc421bd86ab496
Source of Spectrum A1-17-2808/SM6-trans_2b
Wiley ID 1807050