| SpectraBase Spectrum ID |
Hu6g9mrhBom |
| Name |
bis(Perfluoropropyl)-[(.alpha.-2',2',2'-trifluoroethyl)benzyl]phosphate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
620.004524567 u |
| Formula |
C16H10F17O4P |
| InChI |
InChI=1S/C16H10F17O4P/c17-10(18,13(24,25)15(28,29)30)6-35-38(34,36-7-11(19,20)14(26,27)16(31,32)33)37-9(12(21,22)23)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| InChIKey |
HLMPNIOCQGAAGO-UHFFFAOYSA-N |
| Molecular Weight |
620.199 g/mol |
| SMILES |
C(C(COP(OC(C(F)(F)F)C=1C=CC=CC1)(OCC(C(C(F)(F)F)(F)F)(F)F)=O)(F)F)(C(F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826716 |
![bis(Perfluoropropyl)-[(.alpha.-2',2',2'-trifluoroethyl)benzyl]phosphate](/api/spectrum/Hu6g9mrhBom/structure.png?h=300&w=458 "bis(Perfluoropropyl)-[(.alpha.-2',2',2'-trifluoroethyl)benzyl]phosphate")
