| SpectraBase Spectrum ID |
DPTX9vza3ig |
| Name |
N-(4-Carboxyphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.115758027 u |
| Formula |
C25H17NO4 |
| InChI |
InChI=1S/C25H17NO4/c27-23-21-19-15-5-1-2-6-16(15)20(18-8-4-3-7-17(18)19)22(21)24(28)26(23)14-11-9-13(10-12-14)25(29)30/h1-12,19-22H,(H,29,30)/t19-,20+,21?,22? |
| InChIKey |
QFQFDOUGEWNQKE-FDRBHKFBSA-N |
| Molecular Weight |
395.414 g/mol |
| SMILES |
C12=C(C=CC=C2)[C@]2(C3C([C@@]1(C1=CC=CC=C21)[H])C(N(C3=O)C1=CC=C(C(O)=O)C=C1)=O)[H] |
