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HUHCPQJSXDMLKH-UHFFFAOYSA-N
SpectraBase Compound ID Dy0RiCrr1Pj
InChI InChI=1S/C20H16Cl2N4O/c1-12-11-18(25(23-12)16-7-3-14(21)4-8-16)19-13(2)24-26(20(19)27)17-9-5-15(22)6-10-17/h3-11,27H,1-2H3
InChIKey HUHCPQJSXDMLKH-UHFFFAOYSA-N
Mol Weight 399.28 g/mol
Molecular Formula C20H16Cl2N4O
Exact Mass 398.070117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Ust2vWgDmG
Name [4,5'-Bi-1H-pyrazol]-5-ol, 1,1'-bis(4-chlorophenyl)-3,3'-dimethyl-
CAS Registry Number 114658-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16Cl2N4O
InChI InChI=1S/C20H16Cl2N4O/c1-12-11-18(25(23-12)16-7-3-14(21)4-8-16)19-13(2)24-26(20(19)27)17-9-5-15(22)6-10-17/h3-11,27H,1-2H3
InChIKey HUHCPQJSXDMLKH-UHFFFAOYSA-N
Molecular Weight 399.281 g/mol
SMILES Oc1c(-c2[n](nc(c2)C)-c2ccc(cc2)Cl)c(n[n]1-c1ccc(cc1)Cl)C
SPLASH splash10-0ika-2918600000-5c6dfb78ab6055404d53
Source of Spectrum AJ-60-4430-8
Synonyms 1-(4-Chlorophenyl)-4-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-3-methyl-1H-pyrazol-5-ol 1-(4-Chlorophenyl)-5-hydroxy-3-methyl-4-[1-4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-1H-pyrazole
Wiley ID 1368296