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(+)-(S,E)-4-(tert-butylsulfonyl)pent-2-ene

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

(+)-(S,E)-4-(tert-butylsulfonyl)pent-2-ene
SpectraBase Compound ID 1o8GS55GRzf
InChI InChI=1S/C9H18O2S/c1-6-7-8(2)12(10,11)9(3,4)5/h6-8H,1-5H3/b7-6+/t8-/m0/s1
InChIKey ZSUQQAKRPIKTDL-CZEYKFRCSA-N
Mol Weight 190.3 g/mol
Molecular Formula C9H18O2S
Exact Mass 190.102751 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6iObN58IgnA
Name (+)-(S,E)-4-(tert-butylsulfonyl)pent-2-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 190.102750992 u
Formula C9H18O2S
InChI InChI=1S/C9H18O2S/c1-6-7-8(2)12(10,11)9(3,4)5/h6-8H,1-5H3/b7-6+/t8-/m0/s1
InChIKey ZSUQQAKRPIKTDL-CZEYKFRCSA-N
Molecular Weight 190.301 g/mol
SMILES C(S(=O)(=O)[C@](\C=C\C)(C)[H])(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959465