| SpectraBase Spectrum ID |
GPhwLSQscHW |
| Name |
3-Pentafluoropropionyloxy-4-methoxybenzoic acid, pentafluoropropionic acid anhydride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.000469537 u |
| Formula |
C14H6F10O6 |
| InChI |
InChI=1S/C14H6F10O6/c1-28-6-3-2-5(8(25)30-10(27)12(17,18)14(22,23)24)4-7(6)29-9(26)11(15,16)13(19,20)21/h2-4H,1H3 |
| InChIKey |
VJVFUNQGPNOYTN-UHFFFAOYSA-N |
| Molecular Weight |
460.180 g/mol |
| SMILES |
C(C1=CC=C(C(=C1)OC(C(C(F)(F)F)(F)F)=O)OC)(=O)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885319 |
