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METHYL-4-ACETAMIDO-5-PHENYLSULFONYLCYCLOHEXA-1,4-DIENECARBOXYLATE
SpectraBase Compound ID As0wPAvAqtu
InChI InChI=1S/C16H17NO5S/c1-11(18)17-14-9-8-12(16(19)22-2)10-15(14)23(20,21)13-6-4-3-5-7-13/h3-8H,9-10H2,1-2H3,(H,17,18)
InChIKey VARFGLZHMXNRIZ-UHFFFAOYSA-N
Mol Weight 335.37 g/mol
Molecular Formula C16H17NO5S
Exact Mass 335.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Z51YoBDpg
Name 4-Acetamido-5-(benzenesulfonyl)-1-cyclohexa-1,4-dienecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO5S
InChI InChI=1S/C16H17NO5S/c1-11(18)17-14-9-8-12(16(19)22-2)10-15(14)23(20,21)13-6-4-3-5-7-13/h3-8H,9-10H2,1-2H3,(H,17,18)
InChIKey VARFGLZHMXNRIZ-UHFFFAOYSA-N
Molecular Weight 335.374 g/mol
SMILES N(C1=C(S(=O)(=O)c2ccccc2)CC(C(=O)OC)=CC1)C(=O)C
SPLASH splash10-0f6x-1930000000-9015b9e4ee2d1ed87d7a
Source of Spectrum KC-0-1696-6
Synonyms 4-Acetamido-5-besyl-cyclohexa-1,4-diene-1-carboxylic acid methyl ester Methyl 4-acetamido-5-(benzenesulfonyl)cyclohexa-1,4-diene-1-carboxylate Methyl 4-acetamido-5-(phenylsulfonyl)cyclohexa-1,4-diene-1-carboxylate
Wiley ID 822694