| SpectraBase Spectrum ID |
CTxeydLPWqg |
| Name |
3-Hydroxy-4-methoxybenzyl alcohol, di(pentafluoropropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.021204983 u |
| Formula |
C14H8F10O5 |
| InChI |
InChI=1S/C14H8F10O5/c1-27-7-3-2-6(5-28-9(25)11(15,16)13(19,20)21)4-8(7)29-10(26)12(17,18)14(22,23)24/h2-4H,5H2,1H3 |
| InChIKey |
MMBBXEVJTBQMFR-UHFFFAOYSA-N |
| Molecular Weight |
446.197 g/mol |
| SMILES |
C1=C(C(=CC=C1COC(C(C(F)(F)F)(F)F)=O)OC)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838609 |
