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2-(4-Bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(cyanomethyl)phenyl]propanamide
SpectraBase Compound ID 6CzMiRiShwy
InChI InChI=1S/C15H14BrN5O3/c1-9-13(16)14(21(23)24)19-20(9)10(2)15(22)18-12-5-3-11(4-6-12)7-8-17/h3-6,10H,7H2,1-2H3,(H,18,22)
InChIKey FIYCBKDMTIGAFG-UHFFFAOYSA-N
Mol Weight 392.21 g/mol
Molecular Formula C15H14BrN5O3
Exact Mass 391.028002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTHH34iHTPj
Name 2-(4-Bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(cyanomethyl)phenyl]propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14BrN5O3
InChI InChI=1S/C15H14BrN5O3/c1-9-13(16)14(21(23)24)19-20(9)10(2)15(22)18-12-5-3-11(4-6-12)7-8-17/h3-6,10H,7H2,1-2H3,(H,18,22)
InChIKey FIYCBKDMTIGAFG-UHFFFAOYSA-N
Molecular Weight 392.213 g/mol
SMILES N(C(C([n]1nc(c(c1C)Br)N(=O)=O)C)=O)c1ccc(CC#N)cc1
SPLASH splash10-0019-3941000000-ecc4def635aa7829a335
Synonyms 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(cyanomethyl)phenyl]propanamide 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[4-(cyanomethyl)phenyl]propanamide 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(cyanomethyl)phenyl]propanamide 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(cyanomethyl)phenyl]propionamide
Wiley ID 1442993