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5-(4-CHLORO-2-HYDROXYPHENYL)-3-(2,4-DICHLOROPHENYL)-1-DECYL-PYRAZOLE
SpectraBase Compound ID MxpESxJAYb
InChI InChI=1S/C25H29Cl3N2O/c1-2-3-4-5-6-7-8-9-14-30-24(21-13-11-19(27)16-25(21)31)17-23(29-30)20-12-10-18(26)15-22(20)28/h10-13,15-17,31H,2-9,14H2,1H3
InChIKey XMPBAVFVBLQMLN-UHFFFAOYSA-N
Mol Weight 479.88 g/mol
Molecular Formula C25H29Cl3N2O
Exact Mass 478.134547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhCVzG2SyuK
Name 5-[2'-Hydroxy-4'-chlorophenyl]-3-(2",4"-dichlorophenyl)-1-decylpyrazole
Alternate Name(s) 5-Chloro-2-[1-decyl-3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29Cl3N2O
InChI InChI=1S/C25H29Cl3N2O/c1-2-3-4-5-6-7-8-9-14-30-24(21-13-11-19(27)16-25(21)31)17-23(29-30)20-12-10-18(26)15-22(20)28/h10-13,15-17,31H,2-9,14H2,1H3
InChIKey XMPBAVFVBLQMLN-UHFFFAOYSA-N
Molecular Weight 479.879 g/mol
SMILES Oc1c(-c2cc(-c3c(cc(cc3)Cl)Cl)n[n]2CCCCCCCCCC)ccc(Cl)c1
SPLASH splash10-0udi-1009500000-7d70068305e3eb373b0a
Source of Spectrum AH-138-809-14
Wiley ID 1612459