2-Anilino-5,5-dimethyl-3-phenyl-6-imidazo[1,2-b][1,2,4]triazolone

SpectraBase Compound ID	8OdJaAgtVKM
InChI	InChI=1S/C18H17N5O/c1-18(2)15(24)23-17(20-18)22(14-11-7-4-8-12-14)16(21-23)19-13-9-5-3-6-10-13/h3-12H,1-2H3,(H,19,21)
InChIKey	ZULHKCUAYXAUID-UHFFFAOYSA-N Google Search
Mol Weight	319.37 g/mol
Molecular Formula	C18H17N5O
Exact Mass	319.14331 g/mol

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SpectraBase Spectrum ID	Ep0z7y1Oowp
Name	2-Anilino-5,5-dimethyl-3-phenyl-6-imidazo[1,2-B][1,2,4]triazolone
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	319.143310186 u
Formula	C18H17N5O
InChI	InChI=1S/C18H17N5O/c1-18(2)15(24)23-17(20-18)22(14-11-7-4-8-12-14)16(21-23)19-13-9-5-3-6-10-13/h3-12H,1-2H3,(H,19,21)
InChIKey	ZULHKCUAYXAUID-UHFFFAOYSA-N
Molecular Weight	319.368 g/mol
SMILES	C=12N(N=C(N2C2=CC=CC=C2)NC=2C=CC=CC2)C(C(N1)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.939785