For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-4-(4-Chloro-phenyl)-4-hydroxy-N-isopropyl-3-tosyl-but-2-enamide
SpectraBase Compound ID EDfIhmkUdPK
InChI InChI=1S/C20H22ClNO4S/c1-13(2)22-19(23)12-18(20(24)15-6-8-16(21)9-7-15)27(25,26)17-10-4-14(3)5-11-17/h4-13,20,24H,1-3H3,(H,22,23)/b18-12+
InChIKey ISAUOBWPZKANOA-LDADJPATSA-N
Mol Weight 407.91 g/mol
Molecular Formula C20H22ClNO4S
Exact Mass 407.095807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Flt5MHNJhzL
Name 2-Butenamide, 4-(4-chlorophenyl)-4-hydroxy-N-(1-methylethyl)-3-[(4-methylphenyl)sulfonyl]-, (E)-
CAS Registry Number 124455-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22ClNO4S
InChI InChI=1S/C20H22ClNO4S/c1-13(2)22-19(23)12-18(20(24)15-6-8-16(21)9-7-15)27(25,26)17-10-4-14(3)5-11-17/h4-13,20,24H,1-3H3,(H,22,23)/b18-12+
InChIKey ISAUOBWPZKANOA-LDADJPATSA-N
Molecular Weight 407.912 g/mol
SMILES N(C(\C=C/(C(c1ccc(cc1)Cl)O)S(c1ccc(cc1)C)(=O)=O)=O)C(C)C
SPLASH splash10-0fr6-9520000000-1f39abc04be9e1d8e89d
Source of Spectrum KC-1989-1389-7
Synonyms (2E)-4-(4-chlorophenyl)-4-hydroxy-N-isopropyl-3-[(4-methylphenyl)sulfonyl]-2-butenamide (E)-4-(p-chlorophenyl)-4-hydroxy-N-isopropyl-3-tosylbut-2-enamide
Wiley ID 1372531