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1H-Pyrazole, 1-benzoyl-5-[(4-chlorobenzoyl)azo]-4,5-dihydro-3,4,4,5-tetramethyl-
SpectraBase Compound ID 7pzFiQU5v5t
InChI InChI=1S/C21H21ClN4O2/c1-14-20(2,3)21(4,25-23-18(27)15-10-12-17(22)13-11-15)26(24-14)19(28)16-8-6-5-7-9-16/h5-13H,1-4H3/b25-23+
InChIKey LXKLSZLIELMEOP-WJTDDFOZSA-N
Mol Weight 396.88 g/mol
Molecular Formula C21H21ClN4O2
Exact Mass 396.135304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc6u4Vxu1q9
Name 1H-Pyrazole, 1-benzoyl-5-[(4-chlorobenzoyl)azo]-4,5-dihydro-3,4,4,5-tetramethyl-
Alternate Name(s) 1-(benzoyl)-5-(p-chlorobenzoyl)azo-3,4,4,5-tetramethyl-2-pyrazolines 1-Benzoyl-5-[(E)-(4-chlorobenzoyl)diazenyl]-3,4,4,5-tetramethyl-4,5-dihydro-1H-pyrazole
CAS Registry Number 87885-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN4O2
InChI InChI=1S/C21H21ClN4O2/c1-14-20(2,3)21(4,25-23-18(27)15-10-12-17(22)13-11-15)26(24-14)19(28)16-8-6-5-7-9-16/h5-13H,1-4H3/b25-23+
InChIKey LXKLSZLIELMEOP-WJTDDFOZSA-N
Molecular Weight 396.878 g/mol
SMILES C1(N(N=C(C1(C)C)C)C(=O)c1ccccc1)(\N=N\C(c1ccc(cc1)Cl)=O)C
SPLASH splash10-0a4r-0930000000-9a335533ef4edd5a2bfb
Source of Spectrum Y-20-849-0
Wiley ID 1367407