| SpectraBase Spectrum ID |
CW4Brq9ebIq |
| Name |
Phloroglucinol, o,o'-di(heptafluorobutyryl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
517.983517506 u |
| Formula |
C14H4F14O5 |
| InChI |
InChI=1S/C14H4F14O5/c15-9(16,11(19,20)13(23,24)25)7(30)32-5-1-4(29)2-6(3-5)33-8(31)10(17,18)12(21,22)14(26,27)28/h1-3,29H |
| InChIKey |
GMVHKPCPAXHBKP-UHFFFAOYSA-N |
| Molecular Weight |
518.159 g/mol |
| SMILES |
C1=C(C=C(C=C1OC(=O)C(C(C(F)(F)F)(F)F)(F)F)O)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936074 |
