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1,3,5-Tris(4-chlorophenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID A7PXxAYpAL5
InChI InChI=1S/C21H15Cl3N2/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)19-11-9-18(24)10-12-19/h1-12,21H,13H2
InChIKey UQUWTZKZUKIQBV-UHFFFAOYSA-N
Mol Weight 401.72 g/mol
Molecular Formula C21H15Cl3N2
Exact Mass 400.030082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGdMd9BTB3g
Name 1,3,5-Tris(4-chlorophenyl)-4,5-dihydro-1H-pyrazole
CAS Registry Number 7245-31-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15Cl3N2
InChI InChI=1S/C21H15Cl3N2/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)19-11-9-18(24)10-12-19/h1-12,21H,13H2
InChIKey UQUWTZKZUKIQBV-UHFFFAOYSA-N
Molecular Weight 401.724 g/mol
SMILES c1cc(C2N(N=C(c3ccc(cc3)Cl)C2)c2ccc(cc2)Cl)ccc1Cl
SPLASH splash10-0fb9-4920200000-4990e4ff1c3663697525
Source of Spectrum AD-0-2532-0
Synonyms 1,3,5-tris(4-chlorophenyl)-2-pyrazoline 2,3,5-tris(4-chlorophenyl)-3,4-dihydropyrazole 2-Pyrazoline, 1,3,5-tri(4-chlorophenyl)-
Wiley ID 1432715