| SpectraBase Spectrum ID |
7QVb7XOXCHN |
| Name |
1,2-Benzenediol, o-(2,3,4-trifluorobenzoyl)-o'-(2,2,3,3,4,4,4-heptafluorobutyryl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
464.010640299 u |
| Formula |
C17H6F10O4 |
| InChI |
InChI=1S/C17H6F10O4/c18-8-6-5-7(11(19)12(8)20)13(28)30-9-3-1-2-4-10(9)31-14(29)15(21,22)16(23,24)17(25,26)27/h1-6H |
| InChIKey |
MRCYJPDTSIZQBP-UHFFFAOYSA-N |
| Molecular Weight |
464.215 g/mol |
| SMILES |
C1(=CC=CC=C1OC(=O)C=1C(F)=C(C(=CC1)F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972719 |
