![(2S,3R)-3-ENDO-[1-(1-METHOXYCARBONYL-ETHYLCARBONYL)-2-PHENYL-ETHYLCARBAMOYL]-BICYCLO-[2.2.1]-HEPT-5-ENE-2-ENDO-CARBOXYLIC-ACID-BENZYLESTER](/api/spectrum/2SNC6G3c0RX/structure.png?h=300&w=458 "(2S,3R)-3-ENDO-[1-(1-METHOXYCARBONYL-ETHYLCARBONYL)-2-PHENYL-ETHYLCARBAMOYL]-BICYCLO-[2.2.1]-HEPT-5-ENE-2-ENDO-CARBOXYLIC-ACID-BENZYLESTER")
| SpectraBase Compound ID | Dou2CzYfAKr |
|---|---|
| InChI | InChI=1S/C29H32N2O6/c1-18(28(34)36-2)30-26(32)23(15-19-9-5-3-6-10-19)31-27(33)24-21-13-14-22(16-21)25(24)29(35)37-17-20-11-7-4-8-12-20/h3-14,18,21-25H,15-17H2,1-2H3,(H,30,32)(H,31,33)/t18-,21+,22-,23-,24+,25+/m0/s1 |
| InChIKey | AYOXLTSJVJRXFJ-IZLJLWKJSA-N |
| Mol Weight | 504.6 g/mol |
| Molecular Formula | C29H32N2O6 |
| Exact Mass | 504.226037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SNC6G3c0RX |
|---|---|
| Name | (2S,3R)-3-ENDO-[1-(1-METHOXYCARBONYL-ETHYLCARBONYL)-2-PHENYL-ETHYLCARBAMOYL]-BICYCLO-[2.2.1]-HEPT-5-ENE-2-ENDO-CARBOXYLIC-ACID-BENZYLESTER |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H32N2O6 |
| InChI | InChI=1S/C29H32N2O6/c1-18(28(34)36-2)30-26(32)23(15-19-9-5-3-6-10-19)31-27(33)24-21-13-14-22(16-21)25(24)29(35)37-17-20-11-7-4-8-12-20/h3-14,18,21-25H,15-17H2,1-2H3,(H,30,32)(H,31,33)/t18-,21+,22-,23-,24+,25+/m0/s1 |
| InChIKey | AYOXLTSJVJRXFJ-IZLJLWKJSA-N |
| Literature Reference Author | C.P.R.HACKENBERGER,I.SCHIFFERS,J.RUNSINK,C.BOLM |
| Literature Reference Citation | J.ORG.CHEM.,69,739(2004) |
| Literature Reference DOI | 10.1021/jo030295+ |
| Molecular Weight | 504.583 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21533 |