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2-[4-(N-Phenylamino-3-oxo-but-2-en-2-yloxy)ethyl]thiol 2-[4-(N-Phenylamino-3-oxo-but-2-en-2-yloxy)ethyl]sulfonate
SpectraBase Compound ID 87LkbVowB9d
InChI InChI=1S/C24H28N2O6S2/c1-19(17-23(27)25-21-9-5-3-6-10-21)31-13-15-33-34(29,30)16-14-32-20(2)18-24(28)26-22-11-7-4-8-12-22/h3-12,17-18H,13-16H2,1-2H3,(H,25,27)(H,26,28)/b19-17+,20-18+
InChIKey QODAWEQTJQNFHG-XPWSMXQVSA-N
Mol Weight 504.62 g/mol
Molecular Formula C24H28N2O6S2
Exact Mass 504.138879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33sZNh4lw6N
Name 2-[4-(N-Phenylamino-3-oxo-but-2-en-2-yloxy)ethyl]thiol 2-[4-(N-Phenylamino-3-oxo-but-2-en-2-yloxy)ethyl]sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28N2O6S2
InChI InChI=1S/C24H28N2O6S2/c1-19(17-23(27)25-21-9-5-3-6-10-21)31-13-15-33-34(29,30)16-14-32-20(2)18-24(28)26-22-11-7-4-8-12-22/h3-12,17-18H,13-16H2,1-2H3,(H,25,27)(H,26,28)/b19-17+,20-18+
InChIKey QODAWEQTJQNFHG-XPWSMXQVSA-N
Molecular Weight 504.616 g/mol
SMILES N(C(\C=C/(OCCS(SCCO\C(=C\C(Nc1ccccc1)=O)C)(=O)=O)C)=O)c1ccccc1
SPLASH splash10-0006-9020000000-e2c4fdcf4e7924259e86
Source of Spectrum QC-25-1384-22
Wiley ID 1584392