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1H-Pyrazole-1-acetic acid, 5-methyl-3-[[(1-methyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino]-, ethyl ester
SpectraBase Compound ID Daw6L4iHjeH
InChI InChI=1S/C13H16N6O5/c1-4-24-12(20)7-18-8(2)5-10(15-18)14-13(21)9-6-11(19(22)23)16-17(9)3/h5-6H,4,7H2,1-3H3,(H,14,15,21)
InChIKey UNUGHNJAIZVUKQ-UHFFFAOYSA-N
Mol Weight 336.31 g/mol
Molecular Formula C13H16N6O5
Exact Mass 336.118218 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6crwXW4fIx4
Name 1H-Pyrazole-1-acetic acid, 5-methyl-3-[[(1-methyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino]-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N6O5
InChI InChI=1S/C13H16N6O5/c1-4-24-12(20)7-18-8(2)5-10(15-18)14-13(21)9-6-11(19(22)23)16-17(9)3/h5-6H,4,7H2,1-3H3,(H,14,15,21)
InChIKey UNUGHNJAIZVUKQ-UHFFFAOYSA-N
Molecular Weight 336.308 g/mol
SMILES N(c1n[n](c(c1)C)CC(=O)OCC)C(c1cc(n[n]1C)N(=O)=O)=O
SPLASH splash10-01p9-5695000000-6ab3dcc377ce26235887
Source of Spectrum IY-2-5067-5
Synonyms Ethyl 2-[5-methyl-3-(1-methyl-3-nitro-1H-pyrazole-5-amido)-1H-pyrazol-1-yl]acetate 2-[5-methyl-3-[[(2-methyl-5-nitro-3-pyrazolyl)-oxomethyl]amino]-1-pyrazolyl]acetic acid ethyl ester Ethyl 2-[5-methyl-3-[(2-methyl-5-nitropyrazole-3-carbonyl)amino]pyrazol-1-yl]acetate Ethyl 2-[5-methyl-3-[(2-methyl-5-nitro-pyrazole-3-carbonyl)amino]pyrazol-1-yl]acetate Ethyl 2-[5-methyl-3-[(2-methyl-5-nitro-pyrazol-3-yl)carbonylamino]pyrazol-1-yl]ethanoate
Wiley ID 1658658