| SpectraBase Spectrum ID |
5uCOrpfKwxy |
| Name |
9-Azabicyclo[6.2.2]dodeca-8,10,11-triene-11,12-dicarboxylic acid, 10-phenyl-, dimethyl ester |
| CAS Registry Number |
90329-75-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23NO4 |
| InChI |
InChI=1S/C21H23NO4/c1-25-20(23)17-15-12-8-3-4-9-13-16(18(17)21(24)26-2)22-19(15)14-10-6-5-7-11-14/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3 |
| InChIKey |
PZGNJQRVSJSCLZ-UHFFFAOYSA-N |
| Molecular Weight |
353.418 g/mol |
| SMILES |
c1(c(c2CCCCCCc1c(n2)-c1ccccc1)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-0udi-0009000000-9853102a31ca4335482c |
| Source of Spectrum |
AJ-58-3103-13 |
| Synonyms |
2-Phenyl-4,5-di(methoxycarbonyl)-3,6-hexanopyridine
dimethyl 10-phenyl-9-azabicyclo[6.2.2]dodeca-1(10),8,11-triene-11,12-dicarboxylate |
| Wiley ID |
1344044 |
![9-Azabicyclo[6.2.2]dodeca-8,10,11-triene-11,12-dicarboxylic acid, 10-phenyl-, dimethyl ester](/api/spectrum/5uCOrpfKwxy/structure.png?h=300&w=458 "9-Azabicyclo[6.2.2]dodeca-8,10,11-triene-11,12-dicarboxylic acid, 10-phenyl-, dimethyl ester")
