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

*Links on SpectraBase are not permalinks.
4-(Ttifluoromethyl)benzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester
SpectraBase Compound ID 68VYdRWGSZL
InChI InChI=1S/C19H21F3O2/c1-5-6-14(4)17(12-7-13(2)3)24-18(23)15-8-10-16(11-9-15)19(20,21)22/h8-11,14,17H,2,5-6H2,1,3-4H3
InChIKey DLRUOGRKJYEPAF-UHFFFAOYSA-N
Mol Weight 338.37 g/mol
Molecular Formula C19H21F3O2
Exact Mass 338.149364 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 1KxziVC1RU9
Name 4-(Ttifluoromethyl)benzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21F3O2
InChI InChI=1S/C19H21F3O2/c1-5-6-14(4)17(12-7-13(2)3)24-18(23)15-8-10-16(11-9-15)19(20,21)22/h8-11,14,17H,2,5-6H2,1,3-4H3
InChIKey DLRUOGRKJYEPAF-UHFFFAOYSA-N
Molecular Weight 338.370 g/mol
SMILES c1cc(ccc1C(OC(C(CCC)C)C#CC(=C)C)=O)C(F)(F)F
SPLASH splash10-00di-3900000000-5c92a6805ae8fc5811fb
Source of Spectrum NP-12-1507-0
Synonyms 4-(trifluoromethyl)benzoic acid 2,6-dimethylnon-1-en-3-yn-5-yl ester [4-methyl-1-(1-methylbutyl)pent-4-en-2-ynyl] 4-(trifluoromethyl)benzoate 2,6-Dimethylnon-1-en-3-yn-5-yl 4-(trifluoromethyl)benzoate
Wiley ID 1110122