| SpectraBase Spectrum ID |
JIHSXiYcS5t |
| Name |
2,3-Dihydroxynaphthalene, bis(pentafluoropropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
452.010640299 u |
| Formula |
C16H6F10O4 |
| InChI |
InChI=1S/C16H6F10O4/c17-13(18,15(21,22)23)11(27)29-9-5-7-3-1-2-4-8(7)6-10(9)30-12(28)14(19,20)16(24,25)26/h1-6H |
| InChIKey |
JPEUHNNXJBUCPJ-UHFFFAOYSA-N |
| Molecular Weight |
452.204 g/mol |
| SMILES |
C1=2C(=CC=CC2)C=C(C(=C1)OC(C(C(F)(F)F)(F)F)=O)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928375 |
