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N-Benzyl-2(4-cyano-5-oxoindeno[1,2-d][1,3]thiazin-2(5H)-ylidene)hydrazinecarbothioamide
SpectraBase Compound ID GUsUhCa8E8N
InChI InChI=1S/C20H13N5OS2/c21-10-15-16-17(13-8-4-5-9-14(13)18(16)26)23-20(28-15)25-24-19(27)22-11-12-6-2-1-3-7-12/h1-9H,11H2,(H2,22,24,27)
InChIKey VFGIKPDPJLBMBQ-UHFFFAOYSA-N
Mol Weight 403.48 g/mol
Molecular Formula C20H13N5OS2
Exact Mass 403.056152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PBoMfPU1UQ
Name N-Benzyl-2(4-cyano-5-oxoindeno[1,2-d][1,3]thiazin-2(5H)-ylidene)hydrazinecarbothioamide
Appearance Orange crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13N5OS2
InChI InChI=1S/C20H13N5OS2/c21-10-15-16-17(13-8-4-5-9-14(13)18(16)26)23-20(28-15)25-24-19(27)22-11-12-6-2-1-3-7-12/h1-9H,11H2,(H2,22,24,27)
InChIKey VFGIKPDPJLBMBQ-UHFFFAOYSA-N
Instrument Name Varian MAT 311
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.e22
Molecular Weight 403.478 g/mol
SMILES N(N=C1N=C2C(C(c3c2cccc3)=O)=C(S1)C#N)C(NCc1ccccc1)=S
SPLASH splash10-06tf-9820100000-f5d0bcce57977482dd95
Source of Spectrum ARK-2007-241-18b
Wiley ID 1868895