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2,5-Hexadienamide, 4-hydroxy-N-(1-methylethyl)-3-[(4-methylphenyl)sulfonyl]-6-phenyl-, (E,E)-
SpectraBase Compound ID J8QTaLMwZbn
InChI InChI=1S/C22H25NO4S/c1-16(2)23-22(25)15-21(20(24)14-11-18-7-5-4-6-8-18)28(26,27)19-12-9-17(3)10-13-19/h4-16,20,24H,1-3H3,(H,23,25)/b14-11+,21-15+
InChIKey SFSCYYFKJPHTDN-KUXVMBIOSA-N
Mol Weight 399.51 g/mol
Molecular Formula C22H25NO4S
Exact Mass 399.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3X1CIVAS9gz
Name 2,5-Hexadienamide, 4-hydroxy-N-(1-methylethyl)-3-[(4-methylphenyl)sulfonyl]-6-phenyl-, (E,E)-
CAS Registry Number 124455-33-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO4S
InChI InChI=1S/C22H25NO4S/c1-16(2)23-22(25)15-21(20(24)14-11-18-7-5-4-6-8-18)28(26,27)19-12-9-17(3)10-13-19/h4-16,20,24H,1-3H3,(H,23,25)/b14-11+,21-15+
InChIKey SFSCYYFKJPHTDN-KUXVMBIOSA-N
Molecular Weight 399.505 g/mol
SMILES N(C(\C=C/(C(\C=C\c1ccccc1)O)S(c1ccc(cc1)C)(=O)=O)=O)C(C)C
SPLASH splash10-0a4l-3910000000-4603d20ff224388eaebd
Source of Spectrum KC-1989-1389-7
Synonyms (2E,5E)-4-hydroxy-N-isopropyl-3-[(4-methylphenyl)sulfonyl]-6-phenyl-2,5-hexadienamide (E,E)-4-Hydroxy-N-isopropyl-6-phenyl-3-tosylhexa-2,5-di-enamide
Wiley ID 1368967