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3-Phenyl-6-p-tolyl-4H-pyrrolo[1,2-c][1,2,3]triazol-4-one
SpectraBase Compound ID H71gGQdK1dH
InChI InChI=1S/C18H13N3O/c1-12-7-9-13(10-8-12)15-11-16(22)18-17(19-20-21(15)18)14-5-3-2-4-6-14/h2-11H,1H3
InChIKey QHAAOHZDJSHXAP-UHFFFAOYSA-N
Mol Weight 287.32 g/mol
Molecular Formula C18H13N3O
Exact Mass 287.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5B8WSy7fVYG
Name 3-Phenyl-6-p-tolyl-4H-pyrrolo[1,2-c][1,2,3]triazol-4-one
Alternate Name(s) 6-(4-Methylphenyl)-3-phenyl-4H-pyrrolo[1,2-c][1,2,3]triazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13N3O
InChI InChI=1S/C18H13N3O/c1-12-7-9-13(10-8-12)15-11-16(22)18-17(19-20-21(15)18)14-5-3-2-4-6-14/h2-11H,1H3
InChIKey QHAAOHZDJSHXAP-UHFFFAOYSA-N
Molecular Weight 287.322 g/mol
SMILES c12[n](nnc2-c2ccccc2)C(=CC1=O)c1ccc(cc1)C
SPLASH splash10-00or-9650000000-e5f7271594f9ebbad54a
Source of Spectrum AJ-67-147-4
Wiley ID 772577