For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-[[2-(3-nitro-1H-pyrazol-1-yl)acetyl]amino]-, methyl ester
SpectraBase Compound ID 5MzCNNX3L0G
InChI InChI=1S/C13H12N4O5/c1-22-13(19)9-4-2-3-5-10(9)14-12(18)8-16-7-6-11(15-16)17(20)21/h2-7H,8H2,1H3,(H,14,18)
InChIKey QLKGESWLEQCVSR-UHFFFAOYSA-N
Mol Weight 304.26 g/mol
Molecular Formula C13H12N4O5
Exact Mass 304.080769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8Y1EQnUhQWx
Name Benzoic acid, 2-[[2-(3-nitro-1H-pyrazol-1-yl)acetyl]amino]-, methyl ester
Alternate Name(s) 2-[[2-(3-nitro-1-pyrazolyl)-1-oxoethyl]amino]benzoic acid methyl ester Methyl 2-[[2-(3-nitropyrazol-1-yl)acetyl]amino]benzoate Methyl 2-[2-(3-nitropyrazol-1-yl)ethanoylamino]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N4O5
InChI InChI=1S/C13H12N4O5/c1-22-13(19)9-4-2-3-5-10(9)14-12(18)8-16-7-6-11(15-16)17(20)21/h2-7H,8H2,1H3,(H,14,18)
InChIKey QLKGESWLEQCVSR-UHFFFAOYSA-N
Molecular Weight 304.262 g/mol
SMILES N(c1c(cccc1)C(OC)=O)C(=O)C[n]1nc(cc1)N(=O)=O
SPLASH splash10-0f6t-5903000000-e956560cd6bbeb731997
Source of Spectrum IY-1-4456-7
Wiley ID 1652550