SpectraBase Spectrum ID |
Gc2lDA7UR9b |
Name |
Acethydrazide, 2,2,2-trifluoro-N2-(4-bromobenzoyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.956474928 u |
Formula |
C9H6BrF3N2O2 |
InChI |
InChI=1S/C9H6BrF3N2O2/c10-6-3-1-5(2-4-6)7(16)14-15-8(17)9(11,12)13/h1-4H,(H,14,16)(H,15,17) |
InChIKey |
VMSTTXJAKMHLOY-UHFFFAOYSA-N |
Molecular Weight |
311.058 g/mol |
SMILES |
C(C(F)(F)F)(NNC(C=1C=CC(=CC1)Br)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801669 |