SpectraBase Spectrum ID |
9gN4DDe8NcS |
Name |
Flavanone (pentafluoropropionyl)hydrazone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
384.089718480 u |
Formula |
C18H13F5N2O2 |
InChI |
InChI=1S/C18H13F5N2O2/c19-17(20,18(21,22)23)16(26)25-24-13-10-15(11-6-2-1-3-7-11)27-14-9-5-4-8-12(13)14/h1-9,15H,10H2,(H,25,26)/b24-13+ |
InChIKey |
IEZRDLFELAPDDQ-ZMOGYAJESA-N |
Molecular Weight |
384.306 g/mol |
SMILES |
C1(OC2=C(\C(C1)=N/NC(C(C(F)(F)F)(F)F)=O)C=CC=C2)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937297 |