| SpectraBase Compound ID | KiBGv7CiSa6 |
|---|---|
| InChI | InChI=1S/C35H54O6/c1-21(36)40-25-20-32(7)26(31(5,6)28(25)41-22(2)37)13-14-34(9)27(32)12-11-23-24-19-30(3,4)15-17-35(24,29(38)39-10)18-16-33(23,34)8/h11,24-28H,12-20H2,1-10H3/t24-,25+,26?,27?,28-,32-,33+,34+,35-/m0/s1 |
| InChIKey | ROHJAYQXFRNZHR-SCLLCDPPSA-N |
| Mol Weight | 570.8 g/mol |
| Molecular Formula | C35H54O6 |
| Exact Mass | 570.392039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7npSMHAjSTf |
|---|---|
| Name | METHYL-2-ALPHA,3-BETA-DI-O-ACETYLOLEAN-12-EN-28-OATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O6 |
| InChI | InChI=1S/C35H54O6/c1-21(36)40-25-20-32(7)26(31(5,6)28(25)41-22(2)37)13-14-34(9)27(32)12-11-23-24-19-30(3,4)15-17-35(24,29(38)39-10)18-16-33(23,34)8/h11,24-28H,12-20H2,1-10H3/t24-,25+,26?,27?,28-,32-,33+,34+,35-/m0/s1 |
| InChIKey | ROHJAYQXFRNZHR-SCLLCDPPSA-N |
| Literature Reference Author | F.J.Q.MONTE,J.P.KINTZINGER,R.BRAZ-FILHO |
| Literature Reference Citation | MAGN.RES.CHEM.,35,802(1997) |
| Literature Reference DOI | 10.1002/(sici)1097-458x(199711)35:11<802::aid-omr173>3.3.co;2-z |
| Molecular Weight | 570.810 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP1273 |