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5-Amino-1-(7-chloroquinolin-4-yl)-4-(2-hydroxy-5-methylbenzoyl)-1H-pyrazole
SpectraBase Compound ID IsMEf1j3oPm
InChI InChI=1S/C20H15ClN4O2/c1-11-2-5-18(26)14(8-11)19(27)15-10-24-25(20(15)22)17-6-7-23-16-9-12(21)3-4-13(16)17/h2-10,26H,22H2,1H3
InChIKey QBOQQWSDGYIUAA-UHFFFAOYSA-N
Mol Weight 378.82 g/mol
Molecular Formula C20H15ClN4O2
Exact Mass 378.088353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zYcvrdEhya
Name 5-Amino-1-(7-chloroquinolin-4-yl)-4-(2-hydroxy-5-methylbenzoyl)-1H-pyrazole
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15ClN4O2
InChI InChI=1S/C20H15ClN4O2/c1-11-2-5-18(26)14(8-11)19(27)15-10-24-25(20(15)22)17-6-7-23-16-9-12(21)3-4-13(16)17/h2-10,26H,22H2,1H3
InChIKey QBOQQWSDGYIUAA-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2355
Molecular Weight 378.819 g/mol
SMILES Nc1c(C(c2c(ccc(c2)C)O)=O)cn[n]1-c1ccnc2c1ccc(c2)Cl
SPLASH splash10-00l2-2944000000-255c646028e402470f90
Source of Spectrum Y-53-863-10
Wiley ID 1876460