| SpectraBase Spectrum ID |
DNOwZO2SrE9 |
| Name |
7,8-Dihydroxy-7,8-dihydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate |
| Alternate Name(s) |
(7S,8S)-7-(acetyloxy)-1-nitro-7,8-dihydrobenzo[def]chrysen-8-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H17NO6 |
| InChI |
InChI=1S/C24H17NO6/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/h3-11,21,24H,1-2H3/t21-,24-/m0/s1 |
| InChIKey |
OTUIWQFNSWBORU-URXFXBBRSA-N |
| Molecular Weight |
415.401 g/mol |
| SMILES |
c12c(c3ccc4c5c3c(c2)ccc5ccc4N(=O)=O)C=C[C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H] |
| SPLASH |
splash10-03di-0009000000-23f418fb711d852e9345 |
| Source of Spectrum |
J-58-7285-9 |
| Wiley ID |
1376019 |
![7,8-Dihydroxy-7,8-dihydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate](/api/spectrum/DNOwZO2SrE9/structure.png?h=300&w=458 "7,8-Dihydroxy-7,8-dihydro-1-nitrobenzo[a]pyrene trans-7,8-Diacetate")
