| SpectraBase Spectrum ID |
3yeRdXwe32T |
| Name |
D-Gluco-Octitol, 3,7-anhydro-1,4-dideoxy-2-C-methyl-, 5,6,8-triacetate 2-(3,5-dinitrobenzoate) |
| Alternate Name(s) |
2-[4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]propan-2-yl 3,5-dinitrobenzoate
3,5-Dinitrobenzoic acid 2-[4,5-diacetyloxy-6-(acetyloxymethyl)-2-oxanyl]propan-2-yl ester
[1-[4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]-1-methyl-ethyl] 3,5-dinitrobenzoate |
| CAS Registry Number |
50692-73-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26N2O13 |
| InChI |
InChI=1S/C22H26N2O13/c1-11(25)33-10-18-20(35-13(3)27)17(34-12(2)26)9-19(36-18)22(4,5)37-21(28)14-6-15(23(29)30)8-16(7-14)24(31)32/h6-8,17-20H,9-10H2,1-5H3 |
| InChIKey |
TVIBDQHFGOUOQL-UHFFFAOYSA-N |
| Molecular Weight |
526.451 g/mol |
| SMILES |
CC(=O)OCC1C(C(CC(C(C)(C)OC(c2cc(cc(c2)N(=O)=O)N(=O)=O)=O)O1)OC(C)=O)OC(C)=O |
| SPLASH |
splash10-0gvo-4910000000-1e0f8429fe6a18ac41e6 |
| Source of Spectrum |
AU-29-465-2 |
| Wiley ID |
1402748 |
