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2-(3-Hydroxy-4-pentenyl)-4-phenylthio-3-sulfolene

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

2-(3-Hydroxy-4-pentenyl)-4-phenylthio-3-sulfolene
SpectraBase Compound ID JFBmPpaMmQg
InChI InChI=1S/C15H18O3S2/c1-2-12(16)8-9-15-10-14(11-20(15,17)18)19-13-6-4-3-5-7-13/h2-7,10,12,15-16H,1,8-9,11H2
InChIKey MOEAZMWDGMYNRK-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C15H18O3S2
Exact Mass 310.069737 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9ppe23GSVms
Name 2-(3-Hydroxy-4-pentenyl)-4-phenylthio-3-sulfolene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.069736785 u
Formula C15H18O3S2
InChI InChI=1S/C15H18O3S2/c1-2-12(16)8-9-15-10-14(11-20(15,17)18)19-13-6-4-3-5-7-13/h2-7,10,12,15-16H,1,8-9,11H2
InChIKey MOEAZMWDGMYNRK-UHFFFAOYSA-N
Molecular Weight 310.426 g/mol
SMILES C1S(C(C=C1SC=1C=CC=CC1)CCC(C=C)O)(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.864912