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Cyclohexanol, 2-[3-(phenylthio)-1-propynyl]-, trans-
SpectraBase Compound ID C10XGlEyTuF
InChI InChI=1S/C15H18OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,9-10,13,15-16H,4-5,7,11-12H2
InChIKey CXZLSWIXVVMYIN-UHFFFAOYSA-N
Mol Weight 246.37 g/mol
Molecular Formula C15H18OS
Exact Mass 246.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4e0Qf3noLP2
Name Cyclohexanol, 2-[3-(phenylthio)-1-propynyl]-, trans-
CAS Registry Number 130158-50-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,9-10,13,15-16H,4-5,7,11-12H2
InChIKey CXZLSWIXVVMYIN-UHFFFAOYSA-N
Molecular Weight 246.368 g/mol
SMILES OC1C(C#CCSc2ccccc2)CCCC1
SPLASH splash10-03di-2920000000-cb81f90f69df009a1595
Source of Spectrum J-56-720-4
Synonyms 2-[3-(phenylsulfanyl)-1-propynyl]cyclohexanol 2-[3-(phenylthio)-1-propynyl]-1-cyclohexanol
Wiley ID 1249135