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(4-{5-Methyl-4-[(4-methylphenyl)diazenyl]-3-trifluoromethyl-1H-pyrazol-1-yl}butyl)-acetate
SpectraBase Compound ID JpXTOabO8yN
InChI InChI=1S/C18H21F3N4O2/c1-12-6-8-15(9-7-12)22-23-16-13(2)25(24-17(16)18(19,20)21)10-4-5-11-27-14(3)26/h6-9H,4-5,10-11H2,1-3H3/b23-22+
InChIKey CMFHMJXJBVHWRE-GHVJWSGMSA-N
Mol Weight 382.39 g/mol
Molecular Formula C18H21F3N4O2
Exact Mass 382.16166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOJBwxwS8Sh
Name (4-{5-Methyl-4-[(4-methylphenyl)diazenyl]-3-trifluoromethyl-1H-pyrazol-1-yl}butyl)-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21F3N4O2
InChI InChI=1S/C18H21F3N4O2/c1-12-6-8-15(9-7-12)22-23-16-13(2)25(24-17(16)18(19,20)21)10-4-5-11-27-14(3)26/h6-9H,4-5,10-11H2,1-3H3/b23-22+
InChIKey CMFHMJXJBVHWRE-GHVJWSGMSA-N
Molecular Weight 382.387 g/mol
SMILES c1(c(n[n](c1C)CCCCOC(=O)C)C(F)(F)F)\N=N\c1ccc(cc1)C
SPLASH splash10-0006-8097000000-c7564972db78f3b3fd77
Source of Spectrum HC-49-1132-3a
Synonyms (4-{5-Methyl-4-[(4-methylphenyl)diazenyl]-3-trifluoromethyl-1H-pyrazol-1-yl}butyl)acetate (E)-4-(5-methyl-4-(p-tolyldiazenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)butyl acetate
Wiley ID 1739514