| SpectraBase Compound ID | 9soV36UEFa6 |
|---|---|
| InChI | InChI=1S/C25H32O4/c1-18(8-5-9-19(2)11-7-13-22-14-15-28-17-22)10-6-12-20(3)16-23-24(26)21(4)25(27)29-23/h5,8-9,11,14-17,23,26H,6-7,10,12-13H2,1-4H3/b9-5+,18-8+,19-11+,20-16+ |
| InChIKey | HAYJQIBGXHVQQH-XICSAWIYSA-N |
| Mol Weight | 396.5 g/mol |
| Molecular Formula | C25H32O4 |
| Exact Mass | 396.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JNxExFjbaqt |
|---|---|
| Name | IRCINIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O4 |
| InChI | InChI=1S/C25H32O4/c1-18(8-5-9-19(2)11-7-13-22-14-15-28-17-22)10-6-12-20(3)16-23-24(26)21(4)25(27)29-23/h5,8-9,11,14-17,23,26H,6-7,10,12-13H2,1-4H3/b9-5+,18-8+,19-11+,20-16+ |
| InChIKey | HAYJQIBGXHVQQH-XICSAWIYSA-N |
| Literature Reference Author | L.V.MANES,P.CREWS,M.B.KSEBATI,F.J.SCHMITZ |
| Literature Reference Citation | J.NAT.PROD.,49,787(1986) |
| Literature Reference DOI | 10.1021/np50047a004 |
| Molecular Weight | 396.527 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17205 |