For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[4-bromo-3-(3-chloroquioxalin-2-yl)-1-phenyl-1H-pyrazol-5-yl]methyl acetate
SpectraBase Compound ID 15FdII4iV3G
InChI InChI=1S/C20H14BrClN4O2/c1-12(27)28-11-16-17(21)18(25-26(16)13-7-3-2-4-8-13)19-20(22)24-15-10-6-5-9-14(15)23-19/h2-10H,11H2,1H3
InChIKey GGMLWZUHAJAQHG-UHFFFAOYSA-N
Mol Weight 457.72 g/mol
Molecular Formula C20H14BrClN4O2
Exact Mass 455.998866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 94w6I7dXMmL
Name [4-bromo-3-(3-chloroquioxalin-2-yl)-1-phenyl-1H-pyrazol-5-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14BrClN4O2
InChI InChI=1S/C20H14BrClN4O2/c1-12(27)28-11-16-17(21)18(25-26(16)13-7-3-2-4-8-13)19-20(22)24-15-10-6-5-9-14(15)23-19/h2-10H,11H2,1H3
InChIKey GGMLWZUHAJAQHG-UHFFFAOYSA-N
Molecular Weight 457.715 g/mol
SMILES c1(n[n](-c2ccccc2)c(c1Br)COC(=O)C)-c1nc2ccccc2nc1Cl
SPLASH splash10-002r-0009200000-bc87e6d6606401e09d91
Source of Spectrum Y-48-1221-9a
Synonyms Acetic acid [4-bromo-5-(3-chloro-2-quinoxalinyl)-2-phenyl-3-pyrazolyl]methyl ester [4-bromo-5-(3-chloroquinoxalin-2-yl)-2-phenylpyrazol-3-yl]methyl acetate [4-bromo-5-(3-chloroquinoxalin-2-yl)-2-phenyl-pyrazol-3-yl]methyl acetate [4-bromanyl-5-(3-chloranylquinoxalin-2-yl)-2-phenyl-pyrazol-3-yl]methyl ethanoate
Wiley ID 1704565