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Benzoic acid, 2-methoxy-, [1,2,4]triazolo[3,4-a]phthalazin-3-yl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Benzoic acid, 2-methoxy-, [1,2,4]triazolo[3,4-a]phthalazin-3-yl ester
SpectraBase Compound ID 6ZPaMN2teSb
InChI InChI=1S/C17H12N4O3/c1-23-14-9-5-4-8-13(14)16(22)24-17-20-19-15-12-7-3-2-6-11(12)10-18-21(15)17/h2-10H,1H3
InChIKey UGRMFEUMCQRBBW-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 J6XYP455ToG
Name Benzoic acid, 2-methoxy-, [1,2,4]triazolo[3,4-A]phthalazin-3-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.090940259 u
Formula C17H12N4O3
InChI InChI=1S/C17H12N4O3/c1-23-14-9-5-4-8-13(14)16(22)24-17-20-19-15-12-7-3-2-6-11(12)10-18-21(15)17/h2-10H,1H3
InChIKey UGRMFEUMCQRBBW-UHFFFAOYSA-N
Molecular Weight 320.308 g/mol
SMILES C=12N(C(OC(=O)C=3C=CC=CC3OC)=NN1)N=CC=1C2=CC=CC1