| SpectraBase Spectrum ID |
6sjwcdL8GSl |
| Name |
(P)-1,12-Dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxyloic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H14N2O8 |
| InChI |
InChI=1S/C22H14N2O8/c1-9-3-5-14(23(29)30)19-12(21(25)26)7-11-8-13(22(27)28)20-15(24(31)32)6-4-10(2)17(20)18(11)16(9)19/h3-8H,1-2H3,(H,25,26)(H,27,28) |
| InChIKey |
ABAGHNLKHXEVCM-UHFFFAOYSA-N |
| Molecular Weight |
434.360 g/mol |
| SMILES |
OC(c1c2c(c3c4c(c(C(=O)O)cc3c1)c(ccc4C)N(=O)=O)c(ccc2N(=O)=O)C)=O |
| SPLASH |
splash10-000i-0009000000-64c06b1b3ca52d0cf4b2 |
| Source of Spectrum |
J-66-560-8 |
| Synonyms |
1,12-dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxylic acid |
| Wiley ID |
1534239 |
![(P)-1,12-Dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxyloic acid](/api/spectrum/6sjwcdL8GSl/structure.png?h=300&w=458 "(P)-1,12-Dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxyloic acid")
