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4-(4-amino-1,2,5-thiadiazol-3-yl)benzonitrile
SpectraBase Compound ID A2LWmylU5cG
InChI InChI=1S/C9H6N4S/c10-5-6-1-3-7(4-2-6)8-9(11)13-14-12-8/h1-4H,(H2,11,13)
InChIKey KVSXXNAJJAJWKQ-UHFFFAOYSA-N
Mol Weight 202.23 g/mol
Molecular Formula C9H6N4S
Exact Mass 202.031317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dxq2fiAqZIa
Name 4-(4-amino-1,2,5-thiadiazol-3-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N4S
InChI InChI=1S/C9H6N4S/c10-5-6-1-3-7(4-2-6)8-9(11)13-14-12-8/h1-4H,(H2,11,13)
InChIKey KVSXXNAJJAJWKQ-UHFFFAOYSA-N
Molecular Weight 202.235 g/mol
SMILES Nc1c(nsn1)-c1ccc(C#N)cc1
SPLASH splash10-0uk9-7590000000-3a8e4ce50d2db97aebd4
Source of Spectrum KC-0-258-10
Synonyms 4-(4-azanyl-1,2,5-thiadiazol-3-yl)benzenecarbonitrile
Wiley ID 783006