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(3-Methyl-6-propan-2-ylidene-cyclohex-2-en-1-yl)methylsulfanylbenzene

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

(3-Methyl-6-propan-2-ylidene-cyclohex-2-en-1-yl)methylsulfanylbenzene
SpectraBase Compound ID C62X4ClUIJm
InChI InChI=1S/C17H22S/c1-13(2)17-10-9-14(3)11-15(17)12-18-16-7-5-4-6-8-16/h4-8,11,15H,9-10,12H2,1-3H3
InChIKey CYMXQAJRKOEMAF-UHFFFAOYSA-N
Mol Weight 258.42 g/mol
Molecular Formula C17H22S
Exact Mass 258.144222 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6eF4GGthv80
Name (3-Methyl-6-propan-2-ylidene-cyclohex-2-en-1-yl)methylsulfanylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.144221882 u
Formula C17H22S
InChI InChI=1S/C17H22S/c1-13(2)17-10-9-14(3)11-15(17)12-18-16-7-5-4-6-8-16/h4-8,11,15H,9-10,12H2,1-3H3
InChIKey CYMXQAJRKOEMAF-UHFFFAOYSA-N
Molecular Weight 258.423 g/mol
SMILES C1(C(C=C(CC1)C)CSC=1C=CC=CC1)=C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822309