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1-Penten-3-ol, 4-methyl-1-(phenylsulfonyl)-, (E)-
SpectraBase Compound ID 2TGu1AsFZXK
InChI InChI=1S/C12H16O3S/c1-10(2)12(13)8-9-16(14,15)11-6-4-3-5-7-11/h3-10,12-13H,1-2H3/b9-8+
InChIKey PEXSLQWTOBMNTD-CMDGGOBGSA-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 DVFpp0yvWW4
Name 1-Penten-3-ol, 4-methyl-1-(phenylsulfonyl)-, (E)-
CAS Registry Number 129083-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3S
InChI InChI=1S/C12H16O3S/c1-10(2)12(13)8-9-16(14,15)11-6-4-3-5-7-11/h3-10,12-13H,1-2H3/b9-8+
InChIKey PEXSLQWTOBMNTD-CMDGGOBGSA-N
Molecular Weight 240.317 g/mol
SMILES OC(\C=C\S(=O)(=O)c1ccccc1)C(C)C
SPLASH splash10-002b-1900000000-4037e7e6cbbc2a4228de
Source of Spectrum F-46-7203-2
Synonyms (E)-1-(benzenesulfonyl)-4-methyl-1-penten-3-ol (E)-1-(benzenesulfonyl)-4-methyl-pent-1-en-3-ol (E)-1-besyl-4-methyl-pent-1-en-3-ol (E)-4-methyl-1-(phenylsulfonyl)pent-1-en-3-ol
Wiley ID 1242629