| SpectraBase Compound ID | AsApn4PwDmY |
|---|---|
| InChI | InChI=1S/C32H50O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h10-11,20-21,24,26-27H,12-19H2,1-9H3/t20-,21+,24-,26+,27+,29-,30-,31+,32+/m0/s1 |
| InChIKey | AEZBHHCJDSVHSL-NFDOLURPSA-N |
| Mol Weight | 466.8 g/mol |
| Molecular Formula | C32H50O2 |
| Exact Mass | 466.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7UpvDLf15cZ |
|---|---|
| Name | Ursa-9(11):12-dien-3.beta.-yl-acetate |
| CAS Registry Number | 41607-46-9 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C32H50O2 |
| InChI | InChI=1S/C32H50O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h10-11,20-21,24,26-27H,12-19H2,1-9H3/t20-,21+,24-,26+,27+,29-,30-,31+,32+/m0/s1 |
| InChIKey | AEZBHHCJDSVHSL-NFDOLURPSA-N |
| Instrument Name | SF = 300 MHz |
| Literature Reference | Phytochem. 27, 535 (1988). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |