For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-2-[3-(tert-Butyl)hept-1-en-1-yl]-1-[4-(trifluoromethyl)phenyl]-1H-benzo[d]imidazole
SpectraBase Compound ID BrDq2kPYK1l
InChI InChI=1S/C25H29F3N2/c1-5-6-9-18(24(2,3)4)14-17-23-29-21-10-7-8-11-22(21)30(23)20-15-12-19(13-16-20)25(26,27)28/h7-8,10-18H,5-6,9H2,1-4H3/b17-14+
InChIKey DRQDDELGYJVXNN-SAPNQHFASA-N
Mol Weight 414.52 g/mol
Molecular Formula C25H29F3N2
Exact Mass 414.228283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Bknk7F4KHAA
Name (E)-2-[3-(tert-Butyl)hept-1-en-1-yl]-1-[4-(trifluoromethyl)phenyl]-1H-benzo[d]imidazole
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.228283431 u
Formula C25H29F3N2
InChI InChI=1S/C25H29F3N2/c1-5-6-9-18(24(2,3)4)14-17-23-29-21-10-7-8-11-22(21)30(23)20-15-12-19(13-16-20)25(26,27)28/h7-8,10-18H,5-6,9H2,1-4H3/b17-14+
InChIKey DRQDDELGYJVXNN-SAPNQHFASA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709087
Molecular Weight 414.516 g/mol
Reported Formula C25H29N2F3
SMILES C(C)(C)(C)C(CCCC)\C=C\C1=NC=2C=CC=CC2N1C=1C=CC(C(F)(F)F)=CC1
SPLASH splash10-0aor-0009000000-6fe9b2d6ddd9d9876f80
Source of Spectrum ACI-56-SM23-4pa (DOI: 10.1002/anie.201709087)
Wiley ID 1896632