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1,8a-Dihydro-7-methyl-1-(4'-nitrophenyl)-3-phenyl-1,2,4-triazolo[4,3-a]pyrimidine
SpectraBase Compound ID AOEnm9fDEYY
InChI InChI=1S/C18H15N5O2/c1-13-11-12-21-17(14-5-3-2-4-6-14)20-22(18(21)19-13)15-7-9-16(10-8-15)23(24)25/h2-12,18H,1H3
InChIKey KSQUGMWJXSENCG-UHFFFAOYSA-N
Mol Weight 333.35 g/mol
Molecular Formula C18H15N5O2
Exact Mass 333.122575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GW4MSsAAL7E
Name 1,8a-Dihydro-7-methyl-1-(4'-nitrophenyl)-3-phenyl-1,2,4-triazolo[4,3-a]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N5O2
InChI InChI=1S/C18H15N5O2/c1-13-11-12-21-17(14-5-3-2-4-6-14)20-22(18(21)19-13)15-7-9-16(10-8-15)23(24)25/h2-12,18H,1H3
InChIKey KSQUGMWJXSENCG-UHFFFAOYSA-N
Molecular Weight 333.351 g/mol
SMILES C12N(C(=NN2c2ccc(N(=O)=O)cc2)c2ccccc2)C=CC(=N1)C
SPLASH splash10-000l-9252000000-7c01c48ea845c8b7b724
Source of Spectrum U-1994-1010-6
Synonyms 7-Methyl-1-(4-nitrophenyl)-3-phenyl-1,8a-dihydro[1,2,4]triazolo[4,3-a]pyrimidine
Wiley ID 766171