| SpectraBase Compound ID | 4JQ4WU8duab |
|---|---|
| InChI | InChI=1S/C35H54O6/c1-20-13-16-35(30(38)39-10)18-17-33(8)24(28(35)21(20)2)11-12-27-32(7)19-25(40-22(3)36)29(41-23(4)37)31(5,6)26(32)14-15-34(27,33)9/h11,20-21,25-29H,12-19H2,1-10H3/t20-,21+,25-,26?,27?,28+,29-,32+,33-,34-,35+/m1/s1 |
| InChIKey | OFENEEUMCBVFDF-FTWMVIBWSA-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 | 2Ti31XU91Xi |
|---|---|
| Name | METHYL-2-ALPHA,3-ALPHA-DI-O-ACETYLURS-12-EN-28-OATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O6 |
| InChI | InChI=1S/C35H54O6/c1-20-13-16-35(30(38)39-10)18-17-33(8)24(28(35)21(20)2)11-12-27-32(7)19-25(40-22(3)36)29(41-23(4)37)31(5,6)26(32)14-15-34(27,33)9/h11,20-21,25-29H,12-19H2,1-10H3/t20-,21+,25-,26?,27?,28+,29-,32+,33-,34-,35+/m1/s1 |
| InChIKey | OFENEEUMCBVFDF-FTWMVIBWSA-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 | UWCP1274 |