| SpectraBase Spectrum ID |
pkatYHaLYJ |
| Name |
(.+/-.)-naringenin, o,o'-bis(heptafluorobutyryl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
664.020296937 u |
| Formula |
C23H10F14O7 |
| InChI |
InChI=1S/C23H10F14O7/c24-18(25,20(28,29)22(32,33)34)16(40)42-9-3-1-8(2-4-9)13-7-12(39)15-11(38)5-10(6-14(15)44-13)43-17(41)19(26,27)21(30,31)23(35,36)37/h1-6,13,38H,7H2 |
| InChIKey |
YPKYMBZEVUBIDE-UHFFFAOYSA-N |
| Molecular Weight |
664.304 g/mol |
| SMILES |
C12=CC(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=CC(=C2C(CC(O1)C1=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961158 |
