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2-(2-[3,5-diamino-4H-pyrazol-4-ylidene]hydrazinyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
SpectraBase Compound ID IPjuAev4Pki
InChI InChI=1S/C13H17N7OS/c14-10-9(11(15)19-18-10)17-20-13-8(12(16)21)6-4-2-1-3-5-7(6)22-13/h20H,1-5H2,(H2,16,21)(H4,14,15,17,18,19)
InChIKey XVNLONXUKVYXMR-UHFFFAOYSA-N
Mol Weight 319.39 g/mol
Molecular Formula C13H17N7OS
Exact Mass 319.121529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXIoKUB4x8Z
Name 2-(2-[3,5-diamino-4H-pyrazol-4-ylidene]hydrazinyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Appearance Black powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N7OS
InChI InChI=1S/C13H17N7OS/c14-10-9(11(15)19-18-10)17-20-13-8(12(16)21)6-4-2-1-3-5-7(6)22-13/h20H,1-5H2,(H2,16,21)(H4,14,15,17,18,19)
InChIKey XVNLONXUKVYXMR-UHFFFAOYSA-N
Instrument Name QP-1000 Ex
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4041
Molecular Weight 319.387 g/mol
SMILES NC(c1c2CCCCCc2sc1NN=C1C(=NN=C1N)N)=O
SPLASH splash10-004i-9000000000-9b80204fe6afbb2eaf15
Source of Spectrum Y-57-3220-26
Wiley ID 1860335