| SpectraBase Compound ID | 1J7sEYbdD9B |
|---|---|
| InChI | InChI=1S/C28H34O9/c1-14(29)34-18-10-17-24(2,3)36-19-11-20(30)33-13-27(17,19)16-6-8-25(4)21(15-7-9-32-12-15)35-23(31)22-28(25,37-22)26(16,18)5/h7,9,12,16-19,21-22H,6,8,10-11,13H2,1-5H3/t16-,17-,18+,19?,21-,22+,25-,26-,27?,28+/m0/s1 |
| InChIKey | WQDRZTIUAGZBQW-NCZRMLLGSA-N |
| Mol Weight | 514.6 g/mol |
| Molecular Formula | C28H34O9 |
| Exact Mass | 514.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LbbdQHHbw5o |
|---|---|
| Name | 7-ALPHA-LIMONYL-ACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H34O9 |
| InChI | InChI=1S/C28H34O9/c1-14(29)34-18-10-17-24(2,3)36-19-11-20(30)33-13-27(17,19)16-6-8-25(4)21(15-7-9-32-12-15)35-23(31)22-28(25,37-22)26(16,18)5/h7,9,12,16-19,21-22H,6,8,10-11,13H2,1-5H3/t16-,17-,18+,19?,21-,22+,25-,26-,27?,28+/m0/s1 |
| InChIKey | WQDRZTIUAGZBQW-NCZRMLLGSA-N |
| Literature Reference Author | E.M.K.WIJERATNE,B.M.R.BANDARA,A.A.L.GUNATILAKA,Y.TEZUKA,T.KI KUCHI |
| Literature Reference Citation | J.NAT.PROD.,55,1261(1992) |
| Literature Reference DOI | 10.1021/np50087a013 |
| Molecular Weight | 514.573 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS200 |