| SpectraBase Spectrum ID |
BAQh0FsKsaH |
| Name |
Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl phenethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.092084295 u |
| Formula |
C17H16F8O4 |
| InChI |
InChI=1S/C17H16F8O4/c18-14(19)16(22,23)17(24,25)15(20,21)10-29-13(27)7-6-12(26)28-9-8-11-4-2-1-3-5-11/h1-5,14H,6-10H2 |
| InChIKey |
BPOQOGPKAHOLMW-UHFFFAOYSA-N |
| Molecular Weight |
436.298 g/mol |
| SMILES |
C(CC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCCC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90768 |
