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5-amino-4-imino-3-(1-naphthylmethyleneamino)-2-thioxo-1H-pyrimidine-6-carbonitrile
SpectraBase Compound ID 7QtRNtEBT1L
InChI InChI=1S/C16H12N6S/c17-8-13-14(18)15(19)22(16(23)21-13)20-9-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,9,19H,18H2,(H,21,23)
InChIKey CJYVVWHPIAJWQX-UHFFFAOYSA-N
Mol Weight 320.37 g/mol
Molecular Formula C16H12N6S
Exact Mass 320.084416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EExoaBzGFIF
Name 5-amino-4-imino-3-(1-naphthylmethyleneamino)-2-thioxo-1H-pyrimidine-6-carbonitrile
Appearance Reddish brown
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N6S
InChI InChI=1S/C16H12N6S/c17-8-13-14(18)15(19)22(16(23)21-13)20-9-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,9,19H,18H2,(H,21,23)
InChIKey CJYVVWHPIAJWQX-UHFFFAOYSA-N
Instrument Name JEOL JMS-600
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2495
Molecular Weight 320.374 g/mol
SMILES NC=1C(N(C(NC1C#N)=S)N=Cc1c2c(ccc1)cccc2)=N
SPLASH splash10-00di-0491000000-7e4a6a2d4e84f7269a4d
Source of Spectrum Y-53-1841-4e
Wiley ID 1876703