| SpectraBase Compound ID | AV3Q2aos5le |
|---|---|
| InChI | InChI=1S/C25H31NO5/c1-2-3-4-5-14-23(28)26-15-8-12-21-17-20-11-7-10-19(30-20)16-18-9-6-13-22(27)24(18)25(29)31-21/h3-6,8-9,13-15,19-21,27H,2,7,10-12,16-17H2,1H3,(H,26,28)/b4-3-,14-5-,15-8+/t19-,20-,21+/m1/s1 |
| InChIKey | YJLWVESOLSFGGC-KTUMCVOMSA-N |
| Mol Weight | 425.53 g/mol |
| Molecular Formula | C25H31NO5 |
| Exact Mass | 425.220223 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D1miOwMDqyz |
|---|---|
| Name | YJLWVESOLSFGGC-KTUMCVOMSA-N |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H31NO5 |
| InChI | InChI=1S/C25H31NO5/c1-2-3-4-5-14-23(28)26-15-8-12-21-17-20-11-7-10-19(30-20)16-18-9-6-13-22(27)24(18)25(29)31-21/h3-6,8-9,13-15,19-21,27H,2,7,10-12,16-17H2,1H3,(H,26,28)/b4-3-,14-5-,15-8+/t19-,20-,21+/m1/s1 |
| InChIKey | YJLWVESOLSFGGC-KTUMCVOMSA-N |
| Literature Reference Author | A.F.PETRI,F.SASSE,M.E.MAIER |
| Literature Reference Citation | EUR.J.ORG.CHEM.,1865(2005) |
| Molecular Weight | 425.525 g/mol |
| Sample ID | 39156 |
| Solvent | ACETONE-D6 |