| SpectraBase Compound ID | Bci3oHQ1cN6 |
|---|---|
| InChI | InChI=1S/C16H20O5/c1-7-6-12-13(8(2)16(19)21-12)15(20-9(3)17)14-10(7)4-5-11(14)18/h7,10,12-15H,2,4-6H2,1,3H3/t7-,10+,12+,13-,14?,15+/m1/s1 |
| InChIKey | YQURDSNGRPRTJQ-MTQIKDKISA-N |
| Mol Weight | 292.33 g/mol |
| Molecular Formula | C16H20O5 |
| Exact Mass | 292.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6MbMmCvwhXb |
|---|---|
| Name | ERGOLIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H20O5 |
| InChI | InChI=1S/C16H20O5/c1-7-6-12-13(8(2)16(19)21-12)15(20-9(3)17)14-10(7)4-5-11(14)18/h7,10,12-15H,2,4-6H2,1,3H3/t7-,10+,12+,13-,14?,15+/m1/s1 |
| InChIKey | YQURDSNGRPRTJQ-MTQIKDKISA-N |
| Literature Reference Author | Q.WANG,B.-N.ZHOU,R.-W.ZHANG,Y.-Y.LIN,R.R.GILL,G.A.CORDELL |
| Literature Reference Citation | PLANTA.MED.,62,166(1996) |
| Literature Reference DOI | 10.1055/s-2006-957843 |
| Molecular Weight | 292.332 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP816 |