| SpectraBase Spectrum ID |
Hxt7tTjvWpR |
| Name |
1,2,4-Tribromo-3H-benzo[B]phenothiazin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
496.772023990 u |
| Formula |
C16H6Br3NOS |
| InChI |
InChI=1S/C16H6Br3NOS/c17-11-12(18)15(21)13(19)16-14(11)20-9-5-7-3-1-2-4-8(7)6-10(9)22-16/h1-6H |
| InChIKey |
IZSSERVHUFJURL-UHFFFAOYSA-N |
| Molecular Weight |
500.002 g/mol |
| SMILES |
C1=CC=CC2=C1C=C1N=C3C(Br)=C(Br)C(=O)C(=C3SC1=C2)Br |
| Spectrum/Structure Validation Score (Raman) |
0.865312 |
![1,2,4-Tribromo-3H-benzo[B]phenothiazin-3-one](/api/spectrum/Hxt7tTjvWpR/structure.png?h=300&w=458 "1,2,4-Tribromo-3H-benzo[B]phenothiazin-3-one")
