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Benzene, [(4-methyl-3-pentenyl)sulfonyl]-
SpectraBase Compound ID 3lqL17XeWuX
InChI InChI=1S/C12H16O2S/c1-11(2)7-6-10-15(13,14)12-8-4-3-5-9-12/h3-5,7-9H,6,10H2,1-2H3
InChIKey PHUOPIMQCDBFMO-UHFFFAOYSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5apgVzxJk9P
Name Benzene, [(4-methyl-3-pentenyl)sulfonyl]-
Alternate Name(s) 2-Methyl-5-phenylsulfonyl-2-pentene 4-Methyl-3-pentenyl phenyl sulfone [(4-methyl-3-pentenyl)sulfonyl]benzene
CAS Registry Number 59555-69-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-11(2)7-6-10-15(13,14)12-8-4-3-5-9-12/h3-5,7-9H,6,10H2,1-2H3
InChIKey PHUOPIMQCDBFMO-UHFFFAOYSA-N
Molecular Weight 224.318 g/mol
SMILES c1(S(=O)(=O)CCC=C(C)C)ccccc1
SPLASH splash10-03fr-9100000000-203cf35c463286d1d00c
Source of Spectrum F-44-116-2
Wiley ID 1224863