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1-oxo-3-phenyl-3,4-dihydrobenzo[4,5]imidazo[1,2-d][1,2,4]triazin-2(1H)-carboxylic acid benzyl ester
SpectraBase Compound ID 7qX8aYpG34E
InChI InChI=1S/C23H18N4O3/c28-22-26-20-14-8-7-13-19(20)24-21(26)15-25(18-11-5-2-6-12-18)27(22)23(29)30-16-17-9-3-1-4-10-17/h1-14H,15-16H2
InChIKey MLMNPWVXNBSOBH-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C23H18N4O3
Exact Mass 398.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVMcA35PHr2
Name 1-oxo-3-phenyl-3,4-dihydrobenzo[4,5]imidazo[1,2-d][1,2,4]triazin-2(1H)-carboxylic acid benzyl ester
Appearance Brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18N4O3
InChI InChI=1S/C23H18N4O3/c28-22-26-20-14-8-7-13-19(20)24-21(26)15-25(18-11-5-2-6-12-18)27(22)23(29)30-16-17-9-3-1-4-10-17/h1-14H,15-16H2
InChIKey MLMNPWVXNBSOBH-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 398.422 g/mol
SMILES c1cc2c(cc1)[n]1c(n2)CN(N(C1=O)C(OCc1ccccc1)=O)c1ccccc1
SPLASH splash10-0006-9121000000-e65efc1083bf9ec8351a
Source of Spectrum CN110003213A
Wiley ID 1874866