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Methyl 1-phenyl-3-pentene-1-sulfonate
SpectraBase Compound ID pYX5BDnkqY
InChI InChI=1S/C12H16O3S/c1-3-4-10-12(16(13,14)15-2)11-8-6-5-7-9-11/h3-9,12H,10H2,1-2H3/b4-3+
InChIKey CBPQNFQUDTZSNP-ONEGZZNKSA-N
Mol Weight 240.32 g/mol
Molecular Formula C12H16O3S
Exact Mass 240.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mcKEn53MY4
Name Methyl 1-phenyl-3-pentene-1-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3S
InChI InChI=1S/C12H16O3S/c1-3-4-10-12(16(13,14)15-2)11-8-6-5-7-9-11/h3-9,12H,10H2,1-2H3/b4-3+
InChIKey CBPQNFQUDTZSNP-ONEGZZNKSA-N
Molecular Weight 240.317 g/mol
SMILES C(C\C=C\C)(S(=O)(=O)OC)c1ccccc1
SPLASH splash10-0002-2900000000-72a4163cc83d9b49965e
Source of Spectrum K1-2003-3945-4
Synonyms Methyl (3E)-1-phenyl-3-pentene-1-sulfonate
Wiley ID 1521540