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Benzenesulfonic acid, 4-methyl-, 2,4,6-cycloheptatrien-1-ylidene(3-oxo-1-butenyl)hydrazide, (E)-
SpectraBase Compound ID 8lNgiDNjLZl
InChI InChI=1S/C18H18N2O3S/c1-15-9-11-18(12-10-15)24(22,23)20(14-13-16(2)21)19-17-7-5-3-4-6-8-17/h3-14H,1-2H3/b14-13+
InChIKey WUMXPKXNVNJRDE-BUHFOSPRSA-N
Mol Weight 342.41 g/mol
Molecular Formula C18H18N2O3S
Exact Mass 342.103814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dy4xoTTz4QS
Name Benzenesulfonic acid, 4-methyl-, 2,4,6-cycloheptatrien-1-ylidene(3-oxo-1-butenyl)hydrazide, (E)-
CAS Registry Number 113396-51-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O3S
InChI InChI=1S/C18H18N2O3S/c1-15-9-11-18(12-10-15)24(22,23)20(14-13-16(2)21)19-17-7-5-3-4-6-8-17/h3-14H,1-2H3/b14-13+
InChIKey WUMXPKXNVNJRDE-BUHFOSPRSA-N
Molecular Weight 342.413 g/mol
SMILES C1(=NN(S(c2ccc(cc2)C)(=O)=O)\C=C\C(=O)C)C=CC=CC=C1
SPLASH splash10-00li-0790000000-0240b87cf9e3334cee61
Source of Spectrum AJ-60-2107-21
Synonyms 4-Methyl-1-((1-(2-methoxycarbonylethenyl)-2-(cyclohepta-2,4,6-trienyl)diazo)sulfonyl)benzene N'-(2,4,6-cycloheptatrien-1-ylidene)-4-methyl-N-[(1E)-3-oxo-1-butenyl]benzenesulfonohydrazide
Wiley ID 1336438