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2-(p-tolylsulfonylmethyl)pent-4-en-1-ol
SpectraBase Compound ID Hk1E09bUpsN
InChI InChI=1S/C13H18O3S/c1-3-4-12(9-14)10-17(15,16)13-7-5-11(2)6-8-13/h3,5-8,12,14H,1,4,9-10H2,2H3
InChIKey WEODXPKFJDZJQB-UHFFFAOYSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0sDHQzqA4r
Name 2-(p-tolylsulfonylmethyl)pent-4-en-1-ol
Alternate Name(s) 2-(tosylmethyl)pent-4-en-1-ol 2-[(4-methylphenyl)sulfonylmethyl]pent-4-en-1-ol
CAS Registry Number 129665-62-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-3-4-12(9-14)10-17(15,16)13-7-5-11(2)6-8-13/h3,5-8,12,14H,1,4,9-10H2,2H3
InChIKey WEODXPKFJDZJQB-UHFFFAOYSA-N
Molecular Weight 254.344 g/mol
SMILES OCC(CS(c1ccc(cc1)C)(=O)=O)CC=C
SPLASH splash10-052o-9710000000-8bbd7bb96b4713122f2f
Source of Spectrum F-46-3999-6
Wiley ID 1257478