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2-(2-[4-oxothiazolidin-2-ylidene]acetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID 460NHCUHKIt
InChI InChI=1S/C15H17N3O3S2/c16-14(21)13-8-4-2-1-3-5-9(8)23-15(13)18-10(19)6-12-17-11(20)7-22-12/h6H,1-5,7H2,(H2,16,21)(H,17,20)(H,18,19)
InChIKey ZGSSVEOVWSERKU-UHFFFAOYSA-N
Mol Weight 351.44 g/mol
Molecular Formula C15H17N3O3S2
Exact Mass 351.071134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OF51NAmn24
Name 2-(2-[4-oxothiazolidin-2-ylidene]acetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17N3O3S2
InChI InChI=1S/C15H17N3O3S2/c16-14(21)13-8-4-2-1-3-5-9(8)23-15(13)18-10(19)6-12-17-11(20)7-22-12/h6H,1-5,7H2,(H2,16,21)(H,17,20)(H,18,19)
InChIKey ZGSSVEOVWSERKU-UHFFFAOYSA-N
Instrument Name Kratos MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4085
Molecular Weight 351.439 g/mol
SMILES NC(c1c2CCCCCc2sc1NC(C=C1NC(CS1)=O)=O)=O
SPLASH splash10-0a4i-9000000000-6069b457c0c038edb8df
Source of Spectrum Y-57-3670-13
Wiley ID 1859852