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N-Benzyl-N-((E)-3-hydroxyprop-1-enyl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 4uAaEU5kjCx
InChI InChI=1S/C17H19NO3S/c1-15-8-10-17(11-9-15)22(20,21)18(12-5-13-19)14-16-6-3-2-4-7-16/h2-12,19H,13-14H2,1H3/b12-5+
InChIKey XAFBQIUWZCCTPQ-LFYBBSHMSA-N
Mol Weight 317.4 g/mol
Molecular Formula C17H19NO3S
Exact Mass 317.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApS2FktA0yT
Name N-Benzyl-N-((E)-3-hydroxyprop-1-enyl)-4-methylbenzenesulfonamide
Alternate Name(s) (E)-N-benzyl-N-(3-hydroxyprop-1-en-1-yl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO3S
InChI InChI=1S/C17H19NO3S/c1-15-8-10-17(11-9-15)22(20,21)18(12-5-13-19)14-16-6-3-2-4-7-16/h2-12,19H,13-14H2,1H3/b12-5+
InChIKey XAFBQIUWZCCTPQ-LFYBBSHMSA-N
Literature Reference DOI 10.1021/ol0711725
Molecular Weight 317.403 g/mol
SMILES OC\C=C\N(Cc1ccccc1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0a4l-6900000000-888fa395422be2a1ae73
Source of Spectrum A1-9-3245/SMS5-3a
Wiley ID 1758381