methyl 4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoate

SpectraBase Compound ID	IuH1u9QuO1n
InChI	InChI=1S/C12H11N3O4/c1-19-12(16)10-4-2-9(3-5-10)8-14-7-6-11(13-14)15(17)18/h2-7H,8H2,1H3
InChIKey	SGYDPBABHWTHNA-UHFFFAOYSA-N Google Search
Mol Weight	261.24 g/mol
Molecular Formula	C12H11N3O4
Exact Mass	261.074956 g/mol

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SpectraBase Spectrum ID	HqzJRPNZcum
Name	Benzoic acid, 4-(3-nitro-1-pyrazolylmethyl)-, methyl ester
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H11N3O4
InChI	InChI=1S/C12H11N3O4/c1-19-12(16)10-4-2-9(3-5-10)8-14-7-6-11(13-14)15(17)18/h2-7H,8H2,1H3
InChIKey	SGYDPBABHWTHNA-UHFFFAOYSA-N
Molecular Weight	261.237 g/mol
SMILES	c1(N(=O)=O)n[n](Cc2ccc(C(=O)OC)cc2)cc1
SPLASH	splash10-01qd-7980000000-9fd72b708cb648cebfe3
Source of Spectrum	AD-0-2532-0
Synonyms	4-[(3-nitro-1-pyrazolyl)methyl]benzoic acid methyl ester 4-[(3-nitropyrazol-1-yl)methyl]benzoic acid methyl ester Methyl 4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoate Methyl 4-[(3-nitropyrazol-1-yl)methyl]benzoate
Wiley ID	1434883