| SpectraBase Compound ID | 9pk67mk9MkK |
|---|---|
| InChI | InChI=1S/C22H31NO6/c1-4-13-14-7-5-6-8-23(20(14)25)15(17-9-11(2)21(26)28-17)10-16(24)18-12(3)22(27)29-19(13)18/h11-15,17-19H,4-10H2,1-3H3/t11-,12-,13?,14?,15?,17?,18?,19?/m0/s1 |
| InChIKey | CHQGOWAOLJKTQX-YFNVGNFFSA-N |
| Mol Weight | 405.49 g/mol |
| Molecular Formula | C22H31NO6 |
| Exact Mass | 405.215138 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BfFk98ij4QU |
|---|---|
| Name | TUBEROSTEMONONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H31NO6 |
| InChI | InChI=1S/C22H31NO6/c1-4-13-14-7-5-6-8-23(20(14)25)15(17-9-11(2)21(26)28-17)10-16(24)18-12(3)22(27)29-19(13)18/h11-15,17-19H,4-10H2,1-3H3/t11-,12-,13?,14?,15?,17?,18?,19?/m0/s1 |
| InChIKey | CHQGOWAOLJKTQX-YFNVGNFFSA-N |
| Literature Reference Author | W.H.LIN,Y.YE,R.S.XU |
| Literature Reference Citation | J.NAT.PROD.,55,571(1992) |
| Literature Reference DOI | 10.1021/np50083a003 |
| Molecular Weight | 405.491 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS3639 |