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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 2,7-dihydro-2-methyl-7-phenyl-6-(phenylamino)-
SpectraBase Compound ID BHqpaz4FuK4
InChI InChI=1S/C16H14N6S/c1-20-16(23)22-15(19-20)21(13-10-6-3-7-11-13)14(18-22)17-12-8-4-2-5-9-12/h2-11H,1H3,(H,17,18)
InChIKey QLJFSZMJKFSFAX-UHFFFAOYSA-N
Mol Weight 322.39 g/mol
Molecular Formula C16H14N6S
Exact Mass 322.100066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JD2mFYUl1Ve
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 2,7-dihydro-2-methyl-7-phenyl-6-(phenylamino)-
CAS Registry Number 109663-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N6S
InChI InChI=1S/C16H14N6S/c1-20-16(23)22-15(19-20)21(13-10-6-3-7-11-13)14(18-22)17-12-8-4-2-5-9-12/h2-11H,1H3,(H,17,18)
InChIKey QLJFSZMJKFSFAX-UHFFFAOYSA-N
Molecular Weight 322.390 g/mol
SMILES N(C1=NN2C(N1c1ccccc1)=NN(C2=S)C)c1ccccc1
SPLASH splash10-00di-2956000000-1243b8a971fb08d80e40
Source of Spectrum KC-1987-2670-15
Synonyms 6-Anilino-2-methyl-7-phenyl-2,7-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazole-3-thione 7-Phenyl-6-phenylamino-2-methyltriazolo-triazolethione
Wiley ID 1321489