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1H-Pyrazole-3-carboxamide, 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-nitro-
SpectraBase Compound ID L10nXF5W4FP
InChI InChI=1S/C12H9BrN4O5/c13-7-2-10-9(21-5-22-10)1-6(7)3-16-4-8(17(19)20)11(15-16)12(14)18/h1-2,4H,3,5H2,(H2,14,18)
InChIKey NBOUEIIBAMLGLX-UHFFFAOYSA-N
Mol Weight 369.13 g/mol
Molecular Formula C12H9BrN4O5
Exact Mass 367.975632 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6TyCFu0zuhd
Name 1H-Pyrazole-3-carboxamide, 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrN4O5
InChI InChI=1S/C12H9BrN4O5/c13-7-2-10-9(21-5-22-10)1-6(7)3-16-4-8(17(19)20)11(15-16)12(14)18/h1-2,4H,3,5H2,(H2,14,18)
InChIKey NBOUEIIBAMLGLX-UHFFFAOYSA-N
Molecular Weight 369.131 g/mol
SMILES NC(c1n[n](cc1N(=O)=O)Cc1cc2c(cc1Br)OCO2)=O
SPLASH splash10-002r-4590000000-0bc648fe1793d825920b
Source of Spectrum IY-1-4578-7
Synonyms 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-nitro-3-pyrazolecarboxamide 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-nitropyrazole-3-carboxamide 1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-4-nitro-pyrazole-3-carboxamide
Wiley ID 1653770