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(5-Chloropyrazolo[1,5-a]pyrimidin-7-yl)(4-nitrophenyl)methanone
SpectraBase Compound ID 6lBcFNkoBN0
InChI InChI=1S/C13H7ClN4O3/c14-11-7-10(17-12(16-11)5-6-15-17)13(19)8-1-3-9(4-2-8)18(20)21/h1-7H
InChIKey YVIDKJYBJGUSEQ-UHFFFAOYSA-N
Mol Weight 302.68 g/mol
Molecular Formula C13H7ClN4O3
Exact Mass 302.020668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWakY8eE9Og
Name (5-Chloropyrazolo[1,5-a]pyrimidin-7-yl)(4-nitrophenyl)methanone
Appearance Yellow solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.020667798 u
Formula C13H7ClN4O3
GC Column HP 5 (10 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C13H7ClN4O3/c14-11-7-10(17-12(16-11)5-6-15-17)13(19)8-1-3-9(4-2-8)18(20)21/h1-7H
InChIKey YVIDKJYBJGUSEQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/chem.202200733
Quality 145
Reported Formula C13H7ClN4O3
SMILES C1(Cl)=NC=2N(C(=C1)C(=O)C1=CC=C(C=C1)[N+](=O)[O-])N=CC2
SPLASH splash10-00fr-0090000000-fd969ba1fcb2244b0ead
Source of Spectrum QE-28-SM23-18c (DOI: 10.1002/chem.202200733)
Wiley ID 1900417