| SpectraBase Spectrum ID |
6NXLRg0Zqr |
| Name |
ba-A pfp |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
434.115264522 u |
| Formula |
C20H19F5O5 |
| InChI |
InChI=1S/C20H19F5O5/c1-27-15-10-14(8-9-29-18(26)19(21,22)20(23,24)25)11-16(28-2)17(15)30-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3 |
| InChIKey |
SPQZPPRUJKUXDH-UHFFFAOYSA-N |
| Molecular Weight |
434.359 g/mol |
| SMILES |
C(C(F)(F)F)(C(OCCC1=CC(=C(C(=C1)OC)OCC1=CC=CC=C1)OC)=O)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88316 |
