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

*Links on SpectraBase are not permalinks.
1-(4-Methoxyphenyl)-3-[4-(trifluoromethyl)phenyl]prop-2-yn-1-one
SpectraBase Compound ID Ku4jvyrCZwK
InChI InChI=1S/C17H11F3O2/c1-22-15-9-5-13(6-10-15)16(21)11-4-12-2-7-14(8-3-12)17(18,19)20/h2-3,5-10H,1H3
InChIKey RCQQSRBMJDYOTH-UHFFFAOYSA-N
Mol Weight 304.27 g/mol
Molecular Formula C17H11F3O2
Exact Mass 304.071114 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 EfHXTb0fYhY
Name 1-(4-Methoxyphenyl)-3-[4-(trifluoromethyl)phenyl]prop-2-yn-1-one
Appearance Beige solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11F3O2
InChI InChI=1S/C17H11F3O2/c1-22-15-9-5-13(6-10-15)16(21)11-4-12-2-7-14(8-3-12)17(18,19)20/h2-3,5-10H,1H3
InChIKey RCQQSRBMJDYOTH-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 7000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.262
Molecular Weight 304.268 g/mol
SMILES c1cc(ccc1OC)C(=O)C#Cc1ccc(cc1)C(F)(F)F
SPLASH splash10-0fb9-1493000000-c5bd09ce722c8ee4cafa
Source of Spectrum BJO-15-SM13-3k
Thin-Layer Chromatography Rf = 0.16 (n-hexane/EtOAc, 20:1)
Wiley ID 1840966