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4-(1H-1,2,3-Benzotriazol-1-yl)phthalonitrile
SpectraBase Compound ID KS9otqRXPdg
InChI InChI=1S/C14H7N5/c15-8-10-5-6-12(7-11(10)9-16)19-14-4-2-1-3-13(14)17-18-19/h1-7H
InChIKey HABCUEXJOHGRQG-UHFFFAOYSA-N
Mol Weight 245.24 g/mol
Molecular Formula C14H7N5
Exact Mass 245.070145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3IXKVAmCXI
Name 4-(1H-1,2,3-Benzotriazol-1-yl)phthalonitrile
CAS Registry Number 287916-57-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7N5
InChI InChI=1S/C14H7N5/c15-8-10-5-6-12(7-11(10)9-16)19-14-4-2-1-3-13(14)17-18-19/h1-7H
InChIKey HABCUEXJOHGRQG-UHFFFAOYSA-N
Molecular Weight 245.245 g/mol
SMILES c1cc2nn[n](c2cc1)-c1cc(C#N)c(C#N)cc1
SPLASH splash10-01ow-9440000000-ddebad010bc7d6888bb3
Source of Spectrum AD-0-2532-0
Synonyms 1,2,3(1H)-Benzotriazole, 1-(3,4-dicyanophenyl)- 1,2,3-Benzotriazol, 1-(3,4-dicyanophenyl)- 4-(1-benzotriazolyl)benzene-1,2-dicarbonitrile 4-(benzotriazol-1-yl)benzene-1,2-dicarbonitrile 4-(benzotriazol-1-yl)phthalonitrile
Wiley ID 1422718