SpectraBase Compound ID | 8A8b5DbPSc0 |
---|---|
InChI | InChI=1S/C13H10BrNO/c14-11-6-7-13(16)10(8-11)9-15-12-4-2-1-3-5-12/h1-9,16H/b15-9+ |
InChIKey | UBWNXKBHOIRKNG-OQLLNIDSSA-N |
Mol Weight | 276.13 g/mol |
Molecular Formula | C13H10BrNO |
Exact Mass | 274.994577 g/mol |
SpectraBase Spectrum ID | J7lqZOogs2J |
---|---|
Name | 4-Bromo-2-(N-phenylformimidoyl)phenol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 274.994576945 u |
Formula | C13H10BrNO |
InChI | InChI=1S/C13H10BrNO/c14-11-6-7-13(16)10(8-11)9-15-12-4-2-1-3-5-12/h1-9,16H/b15-9+ |
InChIKey | UBWNXKBHOIRKNG-OQLLNIDSSA-N |
SMILES | OC=1C(=CC(=CC1)Br)\C=N\C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) | 0.898465 |