| SpectraBase Spectrum ID |
99NgM337oh5 |
| Name |
1-O-Acetyl-2,3,4,6-tetradeoxy-2-(2,4-dinitrophenylamino)-6-[2,4-dinitrophenylmethyl)amino]-D/L-erythro-hexopyranoside |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22N6O11 |
| InChI |
InChI=1S/C21H22N6O11/c1-12(28)37-21-17(22-16-6-3-13(24(29)30)9-19(16)26(33)34)7-5-15(38-21)11-23(2)18-8-4-14(25(31)32)10-20(18)27(35)36/h3-4,6,8-10,15,17,21-22H,5,7,11H2,1-2H3/t15-,17+,21?/m0/s1 |
| InChIKey |
NYWGFOIKESENOA-ONDKPXHOSA-N |
| Molecular Weight |
534.438 g/mol |
| SMILES |
N(c1c([N+]([O-])=O)cc([N+]([O-])=O)cc1)[C@@]1(CC[C@](OC1OC(=O)C)(CN(c1c([N+]([O-])=O)cc([N+]([O-])=O)cc1)C)[H])[H] |
| SPLASH |
splash10-003r-0000590000-8273ec8775d333c52fac |
| Source of Spectrum |
KC-0-2696-13a |
| Wiley ID |
782287 |
![1-O-Acetyl-2,3,4,6-tetradeoxy-2-(2,4-dinitrophenylamino)-6-[2,4-dinitrophenylmethyl)amino]-D/L-erythro-hexopyranoside](/api/spectrum/99NgM337oh5/structure.png?h=300&w=458 "1-O-Acetyl-2,3,4,6-tetradeoxy-2-(2,4-dinitrophenylamino)-6-[2,4-dinitrophenylmethyl)amino]-D/L-erythro-hexopyranoside")
