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[1,2,4]Triazolo[3,4-a]phthalazine-3-acetonitrile, 6-(4-methylphenyl)-
SpectraBase Compound ID 7ekud7cYI5y
InChI InChI=1S/C18H13N5/c1-12-6-8-13(9-7-12)17-14-4-2-3-5-15(14)18-21-20-16(10-11-19)23(18)22-17/h2-9H,10H2,1H3
InChIKey TWIRLWWWOPDINB-UHFFFAOYSA-N
Mol Weight 299.34 g/mol
Molecular Formula C18H13N5
Exact Mass 299.117095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4MivSFy8qa
Name [1,2,4]Triazolo[3,4-a]phthalazine-3-acetonitrile, 6-(4-methylphenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13N5
InChI InChI=1S/C18H13N5/c1-12-6-8-13(9-7-12)17-14-4-2-3-5-15(14)18-21-20-16(10-11-19)23(18)22-17/h2-9H,10H2,1H3
InChIKey TWIRLWWWOPDINB-UHFFFAOYSA-N
Molecular Weight 299.337 g/mol
SMILES C(c1nnc2-c3c(C(=N[n]12)c1ccc(cc1)C)cccc3)C#N
SPLASH splash10-0005-8790000000-b397229961f3ed3f52dc
Source of Spectrum IY-1-4316-5
Synonyms 2-[6-(4-methylphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]acetonitrile 2-[6-(4-methylphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]ethanenitrile
Wiley ID 1651148