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(E)-5-Tosyl-3-octene

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

(E)-5-Tosyl-3-octene
SpectraBase Compound ID AuS3UiiAAxp
InChI InChI=1S/C15H22O2S/c1-4-6-8-14(7-5-2)18(16,17)15-11-9-13(3)10-12-15/h6,8-12,14H,4-5,7H2,1-3H3/b8-6+
InChIKey DKUUUIJUIBPUPA-SOFGYWHQSA-N
Mol Weight 266.4 g/mol
Molecular Formula C15H22O2S
Exact Mass 266.134051 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8lx5AgNbysx
Name (E)-5-Tosyl-3-octene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.134051120 u
Formula C15H22O2S
InChI InChI=1S/C15H22O2S/c1-4-6-8-14(7-5-2)18(16,17)15-11-9-13(3)10-12-15/h6,8-12,14H,4-5,7H2,1-3H3/b8-6+
InChIKey DKUUUIJUIBPUPA-SOFGYWHQSA-N
Molecular Weight 266.399 g/mol
SMILES C=1(S(=O)(=O)C(\C=C\CC)CCC)C=CC(=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.851327