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(E)-1-Decyl-3-(2-hydroxyphenyl)-4-(4-trifluoromethylstyryl)-1H-pyrazole
SpectraBase Compound ID IbH1qSYahw
InChI InChI=1S/C28H33F3N2O/c1-2-3-4-5-6-7-8-11-20-33-21-23(27(32-33)25-12-9-10-13-26(25)34)17-14-22-15-18-24(19-16-22)28(29,30)31/h9-10,12-19,21,34H,2-8,11,20H2,1H3/b17-14+
InChIKey DEEJDDAIAPAVDO-SAPNQHFASA-N
Mol Weight 470.6 g/mol
Molecular Formula C28H33F3N2O
Exact Mass 470.254498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3im3mOcvIGs
Name (E)-1-Decyl-3-(2-hydroxyphenyl)-4-(4-trifluoromethylstyryl)-1H-pyrazole
Appearance Yellow oil
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Formula C28H33F3N2O
InChI InChI=1S/C28H33F3N2O/c1-2-3-4-5-6-7-8-11-20-33-21-23(27(32-33)25-12-9-10-13-26(25)34)17-14-22-15-18-24(19-16-22)28(29,30)31/h9-10,12-19,21,34H,2-8,11,20H2,1H3/b17-14+
InChIKey DEEJDDAIAPAVDO-SAPNQHFASA-N
Instrument Name VG Autospec Q
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.a19
Molecular Weight 470.580 g/mol
Reported Formula C28H33N2O(19)F3
SMILES Oc1c(-c2n[n](CCCCCCCCCC)cc2\C=C\c2ccc(cc2)C(F)(F)F)cccc1
SPLASH splash10-00di-0429600000-f9b2f66daa2b7527ac99
Source of Spectrum ARK-2010-238-4e
Wiley ID 1866734