| SpectraBase Compound ID | 2RjumdvZxX8 |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-10-36-30(35)18-20-32(9)26(22(4)5)14-12-24(7)28(32)16-15-27-23(6)11-13-25(21(2)3)31(27,8)19-17-29(33)34/h11,25-28H,2,4,7,10,12-20H2,1,3,5-6,8-9H3,(H,33,34)/t25-,26-,27-,28-,31-,32-/m0/s1 |
| InChIKey | ZLSDLEGKMGQSFU-BFIHGEENSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I811kWaWI2d |
|---|---|
| Name | LANSIC_ACID_3-ETHYLESTER |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-10-36-30(35)18-20-32(9)26(22(4)5)14-12-24(7)28(32)16-15-27-23(6)11-13-25(21(2)3)31(27,8)19-17-29(33)34/h11,25-28H,2,4,7,10,12-20H2,1,3,5-6,8-9H3,(H,33,34)/t25-,26-,27-,28-,31-,32-/m0/s1 |
| InChIKey | ZLSDLEGKMGQSFU-BFIHGEENSA-N |
| Literature Reference Author | S.H.DONG,C.R.ZHANG,L.DONG,Y.WU,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,74,1042(2011) |
| Literature Reference DOI | 10.1021/np100943x |
| Molecular Weight | 498.747 g/mol |
| Sample ID | 38130 |
| Solvent | CDCl3 |