| SpectraBase Spectrum ID |
KUnR71e9JpB |
| Name |
10-Azabicyclo[7.2.2]trideca-9,11,12-triene-12,13-dicarboxylic acid, 11-phenyl-, dimethyl ester |
| Alternate Name(s) |
2-Phenyl-4,5-di(methoxycarbonyl)-3,6-heptanopyridine
dimethyl 11-phenyl-10-azabicyclo[7.2.2]trideca-1(11),9,12-triene-12,13-dicarboxylate |
| CAS Registry Number |
104719-74-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO4 |
| InChI |
InChI=1S/C22H25NO4/c1-26-21(24)18-16-13-9-4-3-5-10-14-17(19(18)22(25)27-2)23-20(16)15-11-7-6-8-12-15/h6-8,11-12H,3-5,9-10,13-14H2,1-2H3 |
| InChIKey |
MJUPHCSJGIDJCV-UHFFFAOYSA-N |
| Molecular Weight |
367.445 g/mol |
| SMILES |
c1(c(c2CCCCCCCc1c(n2)-c1ccccc1)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-014i-0009000000-b5b038508517a271fd4a |
| Source of Spectrum |
AJ-58-3102-13 |
| Wiley ID |
1352633 |
![10-Azabicyclo[7.2.2]trideca-9,11,12-triene-12,13-dicarboxylic acid, 11-phenyl-, dimethyl ester](/api/spectrum/KUnR71e9JpB/structure.png?h=300&w=458 "10-Azabicyclo[7.2.2]trideca-9,11,12-triene-12,13-dicarboxylic acid, 11-phenyl-, dimethyl ester")
