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5,6-DIHYDRO-5-OXO-s-TRIAZOLO[1,5-c]QUINAZOLINE-2-CARBOXYLIC ACID,BENZYL ESTER
SpectraBase Compound ID D6mVnYesicQ
InChI InChI=1S/C17H12N4O3/c22-16(24-10-11-6-2-1-3-7-11)14-19-15-12-8-4-5-9-13(12)18-17(23)21(15)20-14/h1-9H,10H2,(H,18,23)
InChIKey WFHNGCVZGRNLCN-UHFFFAOYSA-N
Mol Weight 320.31 g/mol
Molecular Formula C17H12N4O3
Exact Mass 320.09094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H0j7fLwxQ0e
Name 5,6-DIHYDRO-5-OXO-s-TRIAZOLO[1,5-c]QUINAZOLINE-2-CARBOXYLIC ACID,BENZYL ESTER
Source of Sample A. Hardt, W. Bremser BASF Ludwigshafen (1985)
CAS Registry Number 87588-92-9
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N4O3
InChI InChI=1S/C17H12N4O3/c22-16(24-10-11-6-2-1-3-7-11)14-19-15-12-8-4-5-9-13(12)18-17(23)21(15)20-14/h1-9H,10H2,(H,18,23)
InChIKey WFHNGCVZGRNLCN-UHFFFAOYSA-N
Molecular Weight 320.55
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker AM-270
Synonyms S-TRIAZOLO/1,5-C/QUINAZOLINE- 2-CARBOXYLIC ACID, 5,6-DIHYDRO-5-OXO-, BENZYL ESTER