| SpectraBase Spectrum ID |
uqeKFf4fjw |
| Name |
(S)-Methyl 2-methylene-3-(4-(trifluoromethyl)phenyl)pent-4-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.086764146 u |
| Formula |
C14H13F3O2 |
| InChI |
InChI=1S/C14H13F3O2/c1-4-12(9(2)13(18)19-3)10-5-7-11(8-6-10)14(15,16)17/h4-8,12H,1-2H2,3H3/t12-/m1/s1 |
| InChIKey |
HZYQOFXQBJONKN-GFCCVEGCSA-N |
| Molecular Weight |
270.251 g/mol |
| SMILES |
C1(=CC=C(C=C1)C(F)(F)F)[C@@](C(C(OC)=O)=C)(C=C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826581 |
