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5-(4-Chlorophenyl)-3,4-bis(4-ethylphenyl)-1-methyl-1H-pyrazole
SpectraBase Compound ID EyGKoVamPy8
InChI InChI=1S/C26H25ClN2/c1-4-18-6-10-20(11-7-18)24-25(21-12-8-19(5-2)9-13-21)28-29(3)26(24)22-14-16-23(27)17-15-22/h6-17H,4-5H2,1-3H3
InChIKey NKCXYFQIZOQSDC-UHFFFAOYSA-N
Mol Weight 400.95 g/mol
Molecular Formula C26H25ClN2
Exact Mass 400.170627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dq2VlvCjygC
Name 5-(4-Chlorophenyl)-3,4-bis(4-ethylphenyl)-1-methyl-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
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Formula C26H25ClN2
InChI InChI=1S/C26H25ClN2/c1-4-18-6-10-20(11-7-18)24-25(21-12-8-19(5-2)9-13-21)28-29(3)26(24)22-14-16-23(27)17-15-22/h6-17H,4-5H2,1-3H3
InChIKey NKCXYFQIZOQSDC-UHFFFAOYSA-N
Molecular Weight 400.953 g/mol
SMILES c1(c(n[n](c1-c1ccc(cc1)Cl)C)-c1ccc(cc1)CC)-c1ccc(cc1)CC
SPLASH splash10-0udi-0000900000-e9db7f342facdb7d150b
Source of Spectrum F-67-5252-7g
Wiley ID 1686992