| SpectraBase Spectrum ID |
CBVwAexhGE3 |
| Name |
7-(.alpha-Hydroxy-4-nitrobenzyl)-5-isopropyl-2,3-bis(4-nitrobenzyloxy)tropone isomer |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H27N3O10 |
| InChI |
InChI=1S/C31H27N3O10/c1-19(2)23-15-27(29(35)22-7-13-26(14-8-22)34(41)42)30(36)31(44-18-21-5-11-25(12-6-21)33(39)40)28(16-23)43-17-20-3-9-24(10-4-20)32(37)38/h3-16,19,29,35H,17-18H2,1-2H3 |
| InChIKey |
WLNITZMEZUFCBT-UHFFFAOYSA-N |
| Molecular Weight |
601.568 g/mol |
| SMILES |
OC(C=1C(C(=C(OCc2ccc(N(=O)=O)cc2)C=C(C1)C(C)C)OCc1ccc(N(=O)=O)cc1)=O)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-0w30-0505900000-1915b0cfd390e4b38d40 |
| Source of Spectrum |
AJ-64-3312-36 |
| Synonyms |
7-(..alpha.-hydroxy-4-nitrobenzyl)-5-isopropyl-2,3-bis(4-nitrobenzyloxy)tropone isomer
7-[hydroxy(4-nitrophenyl)methyl]-5-isopropyl-2,3-bis[(4-nitrobenzyl)oxy]-2,4,6-cycloheptatrien-1-one |
| Wiley ID |
1410230 |
