| SpectraBase Spectrum ID |
BzEN8VQMz80 |
| Name |
Methyl 3(R')-3-[(R')-3,3,3-trifluoro-2-methoxy-2-phenylpropionyloxy]hex-5-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.118458196 u |
| Formula |
C17H19F3O5 |
| InChI |
InChI=1S/C17H19F3O5/c1-4-8-13(11-14(21)23-2)25-15(22)16(24-3,17(18,19)20)12-9-6-5-7-10-12/h4-7,9-10,13H,1,8,11H2,2-3H3 |
| InChIKey |
GLWRAQJICMOKDU-UHFFFAOYSA-N |
| Molecular Weight |
360.329 g/mol |
| SMILES |
C(C(OC(CC(=O)OC)CC=C)=O)(C(F)(F)F)(C1=CC=CC=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.805673 |
![Methyl 3(R')-3-[(R')-3,3,3-trifluoro-2-methoxy-2-phenylpropionyloxy]hex-5-enoate](/api/spectrum/BzEN8VQMz80/structure.png?h=300&w=458 "Methyl 3(R')-3-[(R')-3,3,3-trifluoro-2-methoxy-2-phenylpropionyloxy]hex-5-enoate")
