| SpectraBase Spectrum ID |
26874rOvL0S |
| Name |
3-(4-nitrophenyl)-2-[3-(4-nitrophenyl)-2H-1,4-benzothiazin-2-yl]-2H-1,4-benzothiazine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H18N4O4S2 |
| InChI |
InChI=1S/C28H18N4O4S2/c33-31(34)19-13-9-17(10-14-19)25-27(37-23-7-3-1-5-21(23)29-25)28-26(18-11-15-20(16-12-18)32(35)36)30-22-6-2-4-8-24(22)38-28/h1-16,27-28H |
| InChIKey |
FWJZDUPGHVGBPY-UHFFFAOYSA-N |
| Molecular Weight |
538.596 g/mol |
| SMILES |
C1(C2C(=Nc3c(S2)cccc3)c2ccc(N(=O)=O)cc2)C(=Nc2c(S1)cccc2)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-014i-0090000000-307f6af13561619908af |
| Source of Spectrum |
SK-21-1717-3 |
| Wiley ID |
851786 |
![3-(4-nitrophenyl)-2-[3-(4-nitrophenyl)-2H-1,4-benzothiazin-2-yl]-2H-1,4-benzothiazine](/api/spectrum/26874rOvL0S/structure.png?h=300&w=458 "3-(4-nitrophenyl)-2-[3-(4-nitrophenyl)-2H-1,4-benzothiazin-2-yl]-2H-1,4-benzothiazine")
