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Benzene, 1-methyl-4-[(2-methyl-2,4-pentadienyl)sulfonyl]-, (E)-
SpectraBase Compound ID FsR4jVFtYPO
InChI InChI=1S/C13H16O2S/c1-4-5-12(3)10-16(14,15)13-8-6-11(2)7-9-13/h4-9H,1,10H2,2-3H3/b12-5+
InChIKey HJPNZVCAXSNNRH-LFYBBSHMSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKZCfXbxKnB
Name Benzene, 1-methyl-4-[(2-methyl-2,4-pentadienyl)sulfonyl]-, (E)-
CAS Registry Number 117734-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-4-5-12(3)10-16(14,15)13-8-6-11(2)7-9-13/h4-9H,1,10H2,2-3H3/b12-5+
InChIKey HJPNZVCAXSNNRH-LFYBBSHMSA-N
Molecular Weight 236.329 g/mol
SMILES c1(S(C\C(=C\C=C)C)(=O)=O)ccc(cc1)C
SPLASH splash10-001i-9100000000-046e1266cc197b63ed2c
Source of Spectrum J-54-125-0
Wiley ID 1237971