| SpectraBase Spectrum ID |
F87wKa51oSo |
| Name |
1-Carbamoyl-3,4-dihydroxy-phenoxazine-7-N,N-dimethyl-ammonium chloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
337.082933703 u |
| Formula |
C15H16ClN3O4 |
| InChI |
InChI=1S/C15H15N3O4.ClH/c1-18(2)7-3-4-9-11(5-7)22-14-12(17-9)8(15(16)21)6-10(19)13(14)20;/h3-6,17,19-20H,1-2H3,(H2,16,21);1H |
| InChIKey |
MQTZMLNJHBFWNO-UHFFFAOYSA-N |
| Molecular Weight |
337.763 g/mol |
| SMILES |
N1C=2C=CC(=CC2OC2=C1C(=CC(=C2O)O)C(N)=O)[NH+](C)C.[Cl-] |
| Spectrum/Structure Validation Score (Raman) |
0.978309 |
