| SpectraBase Spectrum ID |
JTc9p5t222D |
| Name |
Flavanone bis(pentafluoropropionyl)hydrazone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
530.068823881 u |
| Formula |
C21H12F10N2O3 |
| InChI |
InChI=1S/C21H12F10N2O3/c22-18(23,20(26,27)28)16(34)33(17(35)19(24,25)21(29,30)31)32-13-10-15(11-6-2-1-3-7-11)36-14-9-5-4-8-12(13)14/h1-9,15H,10H2/b32-13+ |
| InChIKey |
YYEMTFLENXLVTF-JJKQSNDFSA-N |
| Molecular Weight |
530.322 g/mol |
| SMILES |
C1(OC2=C(\C(C1)=N/N(C(C(C(F)(F)F)(F)F)=O)C(C(C(F)(F)F)(F)F)=O)C=CC=C2)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921416 |
