| SpectraBase Compound ID | K2bBH9XJ3JC |
|---|---|
| InChI | InChI=1S/C30H40O6/c1-18(35-19(2)31)23-13-15-30(34)24-11-10-21-16-22(32)12-14-28(21,3)25(24)17-26(29(23,30)4)36-27(33)20-8-6-5-7-9-20/h5-10,18,22-26,32,34H,11-17H2,1-4H3/t18-,22+,23-,24?,25?,26-,28+,29+,30+/m1/s1 |
| InChIKey | DYUJJBIEXFSWAY-UVQHNRKYSA-N |
| Mol Weight | 496.6 g/mol |
| Molecular Formula | C30H40O6 |
| Exact Mass | 496.282489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ar5kABBpJpw |
|---|---|
| Name | 12-O-BENZOYL-20-O-ACETYL_BOUCERIN |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O6 |
| InChI | InChI=1S/C30H40O6/c1-18(35-19(2)31)23-13-15-30(34)24-11-10-21-16-22(32)12-14-28(21,3)25(24)17-26(29(23,30)4)36-27(33)20-8-6-5-7-9-20/h5-10,18,22-26,32,34H,11-17H2,1-4H3/t18-,22+,23-,24?,25?,26-,28+,29+,30+/m1/s1 |
| InChIKey | DYUJJBIEXFSWAY-UVQHNRKYSA-N |
| Literature Reference Author | T.TANAKA,S.TSUKAMOTO,K.HAYASHI |
| Literature Reference Citation | PHYTOCHEM.,29,229(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)89040-G |
| Molecular Weight | 496.644 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ25527 |