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(E)-Cyclohexyl(2-phenylprop-1-en-1-yl)sulfane

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

(E)-Cyclohexyl(2-phenylprop-1-en-1-yl)sulfane
SpectraBase Compound ID 6btnELR0bJp
InChI InChI=1S/C15H20S/c1-13(14-8-4-2-5-9-14)12-16-15-10-6-3-7-11-15/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3/b13-12+
InChIKey PPMZZJUXFVMHHR-OUKQBFOZSA-N
Mol Weight 232.38 g/mol
Molecular Formula C15H20S
Exact Mass 232.128572 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6CUrZMk8Lsc
Name (E)-Cyclohexyl(2-phenylprop-1-en-1-yl)sulfane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.128571818 u
Formula C15H20S
InChI InChI=1S/C15H20S/c1-13(14-8-4-2-5-9-14)12-16-15-10-6-3-7-11-15/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3/b13-12+
InChIKey PPMZZJUXFVMHHR-OUKQBFOZSA-N
Molecular Weight 232.385 g/mol
SMILES C1(\C(=C\SC2CCCCC2)C)=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.852532