| SpectraBase Spectrum ID |
3i9IcXjNFHz |
| Name |
8,17-Diamino-7,16-dichloro-6,15-dihydrodinaphtho[2,3-A:2',3'-H]phenazine-5,9,14,18-tetrone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
540.039210343 u |
| Formula |
C28H14Cl2N4O4 |
| InChI |
InChI=1S/C28H14Cl2N4O4/c29-17-19(31)13-15(27(37)11-7-3-1-5-9(11)25(13)35)21-23(17)34-22-16-14(20(32)18(30)24(22)33-21)26(36)10-6-2-4-8-12(10)28(16)38/h1-8,33-34H,31-32H2 |
| InChIKey |
NBIFYLJANSMWOZ-UHFFFAOYSA-N |
| Molecular Weight |
541.350 g/mol |
| SMILES |
NC=1C=2C(C=3C=CC=CC3C(C2C2=C(C1Cl)NC=1C(=C(C(=C3C1C(C=1C=CC=CC1C3=O)=O)N)Cl)N2)=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.770825 |
![8,17-Diamino-7,16-dichloro-6,15-dihydrodinaphtho[2,3-a:2',3'-h]phenazine-5,9,14,18-tetrone](/api/spectrum/3i9IcXjNFHz/structure.png?h=300&w=458 "8,17-Diamino-7,16-dichloro-6,15-dihydrodinaphtho[2,3-a:2',3'-h]phenazine-5,9,14,18-tetrone")
