| SpectraBase Spectrum ID |
6rP3bYFQlQu |
| Name |
Succinic acid, 1,1,1-trifluoroprop-2-yl neryl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.170493770 u |
| Formula |
C17H25F3O4 |
| InChI |
InChI=1S/C17H25F3O4/c1-12(2)6-5-7-13(3)10-11-23-15(21)8-9-16(22)24-14(4)17(18,19)20/h6,10,14H,5,7-9,11H2,1-4H3/b13-10- |
| InChIKey |
XSNRVDTXUWIVPF-RAXLEYEMSA-N |
| Molecular Weight |
350.378 g/mol |
| SMILES |
C(CC(OC(C)C(F)(F)F)=O)C(OC\C=C/(CCC=C(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840981 |
