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1-(Phenylethynyl)-cyclohexanol

View entire compound with spectra: 2 FTIR, 1 Raman, and 4 MS (GC)

1-(Phenylethynyl)-cyclohexanol
SpectraBase Compound ID IRViOw8Xn9b
InChI InChI=1S/C14H16O/c15-14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h1,3-4,7-8,15H,2,5-6,10-11H2
InChIKey LBEMYSKBSYEVAG-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dj2SemJheb2
Name 1-(2'-Phenylethynyl)cyclohexanol
CAS Registry Number 20109-09-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c15-14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h1,3-4,7-8,15H,2,5-6,10-11H2
InChIKey LBEMYSKBSYEVAG-UHFFFAOYSA-N
Molecular Weight 200.281 g/mol
SMILES OC1(C#Cc2ccccc2)CCCCC1
SPLASH splash10-0a6r-0920000000-c58c8ae8b56c276cb0ff
Source of Spectrum H-92-899-A
Synonyms 1-(2-phenylethynyl)-1-cyclohexanol 1-(Phenylethynyl)-1-cyclohexanol 1-(2-phenylethynyl)cyclohexan-1-ol 1-(2-Phenylethynyl)cyclohexanol 1-(Phenylethynyl)cyclohexanol
Wiley ID 1693794