| SpectraBase Spectrum ID |
KkDDzV9Hav7 |
| Name |
7,8-Dihydroxy-7,8,9,10-tetrahydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H19NO6 |
| InChI |
InChI=1S/C24H19NO6/c1-12(26)30-21-10-8-16-17-6-7-18-20(25(28)29)9-5-14-3-4-15(23(17)22(14)18)11-19(16)24(21)31-13(2)27/h3-7,9,11,21,24H,8,10H2,1-2H3/t21-,24-/m0/s1 |
| InChIKey |
VVXDRVRCUQIMEB-URXFXBBRSA-N |
| Molecular Weight |
417.417 g/mol |
| SMILES |
c12c(c3ccc4c5c3c(c2)ccc5ccc4N(=O)=O)CC[C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H] |
| SPLASH |
splash10-01ot-0079100000-a871231b104e7ecf23ff |
| Source of Spectrum |
J-58-7285-8 |
| Synonyms |
(7S,8S)-7-(acetyloxy)-1-nitro-7,8,9,10-tetrahydrobenzo[def]chrysen-8-yl acetate |
| Wiley ID |
1376851 |
![7,8-Dihydroxy-7,8,9,10-tetrahydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate](/api/spectrum/KkDDzV9Hav7/structure.png?h=300&w=458 "7,8-Dihydroxy-7,8,9,10-tetrahydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate")
