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2-amino-N-[4-(aminosulfonyl)phenyl]-5,6,7-,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID A8SvZUOuy5p
InChI InChI=1S/C16H19N3O3S2/c17-15-14(12-4-2-1-3-5-13(12)23-15)16(20)19-10-6-8-11(9-7-10)24(18,21)22/h6-9H,1-5,17H2,(H,19,20)(H2,18,21,22)
InChIKey RQKDTNPWINBAHF-UHFFFAOYSA-N
Mol Weight 365.47 g/mol
Molecular Formula C16H19N3O3S2
Exact Mass 365.086784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZTzZRmijQl
Name 2-amino-N-[4-(aminosulfonyl)phenyl]-5,6,7-,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Appearance Brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N3O3S2
InChI InChI=1S/C16H19N3O3S2/c17-15-14(12-4-2-1-3-5-13(12)23-15)16(20)19-10-6-8-11(9-7-10)24(18,21)22/h6-9H,1-5,17H2,(H,19,20)(H2,18,21,22)
InChIKey RQKDTNPWINBAHF-UHFFFAOYSA-N
Instrument Name JEOL-JMS 600
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2576
Molecular Weight 365.466 g/mol
SMILES Nc1c(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c2c(s1)CCCCC2
SPLASH splash10-00ai-8913000000-3545a9f111a400c49a7a
Source of Spectrum Y-54-273-6
Wiley ID 1877812