| SpectraBase Compound ID | 1Reg33l44Vt |
|---|---|
| InChI | InChI=1S/C32H48O5/c1-19-11-14-32(26(35)37-20(2)34)16-15-28(5)22(25(32)31(19,8)36)9-10-24-29(28,6)13-12-23-27(3,4)17-21(18-33)30(23,24)7/h9,17,19,23-25,33,36H,10-16,18H2,1-8H3/t19-,23+,24+,25-,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | WEHPPCZTGCXTLB-ABEFNLCZSA-N |
| Mol Weight | 512.7 g/mol |
| Molecular Formula | C32H48O5 |
| Exact Mass | 512.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C40kiGBF64v |
|---|---|
| Name | HYPTADIENIC-ACID-MONOACETATE |
| Compound Number | 9A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O5 |
| InChI | InChI=1S/C32H48O5/c1-19-11-14-32(26(35)37-20(2)34)16-15-28(5)22(25(32)31(19,8)36)9-10-24-29(28,6)13-12-23-27(3,4)17-21(18-33)30(23,24)7/h9,17,19,23-25,33,36H,10-16,18H2,1-8H3/t19-,23+,24+,25-,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | WEHPPCZTGCXTLB-ABEFNLCZSA-N |
| Literature Reference Author | S.TANIGUCHI,Y.IMAYOSHI,E.KOBAYASHI,Y.TAKAMATSU,H.ITO,T.HATAN O,H.SAKAGAMI,H.TOKUD |
| Literature Reference Citation | PHYTOCHEM.,59,315(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00455-1 |
| Molecular Weight | 512.730 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN2589 |