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3,4,5-Tris(4-ethylphenyl)-1-methyl-1H-pyrazole
SpectraBase Compound ID BXLZkPoVBFQ
InChI InChI=1S/C28H30N2/c1-5-20-8-14-23(15-9-20)26-27(24-16-10-21(6-2)11-17-24)29-30(4)28(26)25-18-12-22(7-3)13-19-25/h8-19H,5-7H2,1-4H3
InChIKey CNPWVDSZOHYFMM-UHFFFAOYSA-N
Mol Weight 394.56 g/mol
Molecular Formula C28H30N2
Exact Mass 394.240899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2N7jQivSGu
Name 3,4,5-Tris(4-ethylphenyl)-1-methyl-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N2
InChI InChI=1S/C28H30N2/c1-5-20-8-14-23(15-9-20)26-27(24-16-10-21(6-2)11-17-24)29-30(4)28(26)25-18-12-22(7-3)13-19-25/h8-19H,5-7H2,1-4H3
InChIKey CNPWVDSZOHYFMM-UHFFFAOYSA-N
Molecular Weight 394.562 g/mol
SMILES c1(c(n[n](c1-c1ccc(cc1)CC)C)-c1ccc(cc1)CC)-c1ccc(cc1)CC
SPLASH splash10-0006-0009000000-ded99f76433b6dd2ed5c
Source of Spectrum F-67-5249-6b
Wiley ID 1687010