| SpectraBase Compound ID | 3FPbBVtoBfT |
|---|---|
| InChI | InChI=1S/C20H28O2/c1-2-3-4-5-6-13-14-9-10-15-16(20(21)22)8-7-12-11-17(13)19(14)18(12)15/h7-10,12-19H,2-6,11H2,1H3,(H,21,22)/t12-,13-,14-,15+,16-,17+,18-,19-/m1/s1 |
| InChIKey | XEQNTXMZKIDUJA-AQCKIFKESA-N |
| Mol Weight | 300.44 g/mol |
| Molecular Formula | C20H28O2 |
| Exact Mass | 300.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HTyACgTq8qi |
|---|---|
| Name | CRYPTOBEILIC_ACID_D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O2 |
| InChI | InChI=1S/C20H28O2/c1-2-3-4-5-6-13-14-9-10-15-16(20(21)22)8-7-12-11-17(13)19(14)18(12)15/h7-10,12-19H,2-6,11H2,1H3,(H,21,22)/t12-,13-,14-,15+,16-,17+,18-,19-/m1/s1 |
| InChIKey | XEQNTXMZKIDUJA-AQCKIFKESA-N |
| Literature Reference Author | F.M.TALONTSI,L.LAMSHOEFT,J.O.BAUER,A.A.RAZAKARIVONY,B.ANDRIA MIHAJA,C.STROHMANN,M |
| Literature Reference Citation | J.NAT.PROD.,76,97(2013) |
| Literature Reference DOI | 10.1021/np300773x |
| Molecular Weight | 300.441 g/mol |
| Sample ID | 42137 |
| Solvent | CDCl3 |