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BENZENEMETHANOL, alpha-[1-(METHYLTHIO)-2-PROPENYL]-alpha-PHENYL-

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

BENZENEMETHANOL, alpha-[1-(METHYLTHIO)-2-PROPENYL]-alpha-PHENYL-
SpectraBase Compound ID BePHxahmlsY
InChI InChI=1S/C17H18OS/c1-3-16(19-2)17(18,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h3-13,16,18H,1H2,2H3
InChIKey RBAPYEVFEPRPFD-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 6aR2vDPsYAI
Name Benzenemethanol, .alpha.-[1-(methylthio)-2-propenyl]-.alpha.-phenyl-
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/c1-3-16(19-2)17(18,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h3-13,16,18H,1H2,2H3
InChIKey RBAPYEVFEPRPFD-UHFFFAOYSA-N
SMILES C1=CC(C(C2=CC=CC=C2)(O)C(C=C)SC)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865724