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(1-(4-Methoxyphenyl)but-3-enyl)(phenyl)sulfane

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

(1-(4-Methoxyphenyl)but-3-enyl)(phenyl)sulfane
SpectraBase Compound ID 2i9jCsDHFr0
InChI InChI=1S/C17H18OS/c1-3-7-17(19-16-8-5-4-6-9-16)14-10-12-15(18-2)13-11-14/h3-6,8-13,17H,1,7H2,2H3
InChIKey NITWZBFTDYYQQG-UHFFFAOYSA-N
Mol Weight 270.39 g/mol
Molecular Formula C17H18OS
Exact Mass 270.107836 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IUPzbE5Bd6W
Name (1-(4-Methoxyphenyl)but-3-enyl)(phenyl)sulfane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.107836373 u
Formula C17H18OS
InChI InChI=1S/C17H18OS/c1-3-7-17(19-16-8-5-4-6-9-16)14-10-12-15(18-2)13-11-14/h3-6,8-13,17H,1,7H2,2H3
InChIKey NITWZBFTDYYQQG-UHFFFAOYSA-N
SMILES C(SC1=CC=CC=C1)(C1=CC=C(C=C1)OC)CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952008