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1-[N-(2-Oxoethyl)(4-methylbenzene)sulfonamide]-3-phenylbut-3-en-2-yl acetate
SpectraBase Compound ID 96CrM1nYGHz
InChI InChI=1S/C21H23NO5S/c1-16-9-11-20(12-10-16)28(25,26)22(13-14-23)15-21(27-18(3)24)17(2)19-7-5-4-6-8-19/h4-12,14,21H,2,13,15H2,1,3H3
InChIKey OSJCUDIAKYSTOZ-UHFFFAOYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H23NO5S
Exact Mass 401.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7J51ARPZrtn
Name 1-[N-(2-Oxoethyl)(4-methylbenzene)sulfonamide]-3-phenylbut-3-en-2-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO5S
InChI InChI=1S/C21H23NO5S/c1-16-9-11-20(12-10-16)28(25,26)22(13-14-23)15-21(27-18(3)24)17(2)19-7-5-4-6-8-19/h4-12,14,21H,2,13,15H2,1,3H3
InChIKey OSJCUDIAKYSTOZ-UHFFFAOYSA-N
Molecular Weight 401.477 g/mol
SMILES C(OC(C)=O)(CN(CC=O)S(c1ccc(C)cc1)(=O)=O)C(c1ccccc1)=C
SPLASH splash10-056r-0393000000-3964984a41764b5417dd
Source of Spectrum KD-51-8027/SM31-13a
Synonyms 1-((4-methyl-N-(2-oxoethyl)phenyl)sulfonamido)-3-phenylbut-3-en-2-yl acetate
Wiley ID 1803681