| SpectraBase Compound ID | CK7egV5tFm0 |
|---|---|
| InChI | InChI=1S/C21H30O5/c1-11-13-4-5-17-20(3)10-14(26-12(2)22)8-15(19(24)25)16(20)6-7-21(17,9-13)18(11)23/h13-18,23H,1,4-10H2,2-3H3,(H,24,25)/t13-,14-,15-,16-,17+,18+,20-,21-/m1/s1 |
| InChIKey | JVBCRJSXTQSIBZ-LMPWRTIWSA-N |
| Mol Weight | 362.47 g/mol |
| Molecular Formula | C21H30O5 |
| Exact Mass | 362.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L21zAV1USgB |
|---|---|
| Name | 2-ACETYL-ATRACTYLIGENIN |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O5 |
| InChI | InChI=1S/C21H30O5/c1-11-13-4-5-17-20(3)10-14(26-12(2)22)8-15(19(24)25)16(20)6-7-21(17,9-13)18(11)23/h13-18,23H,1,4-10H2,2-3H3,(H,24,25)/t13-,14-,15-,16-,17+,18+,20-,21-/m1/s1 |
| InChIKey | JVBCRJSXTQSIBZ-LMPWRTIWSA-N |
| Literature Reference Author | L.N.MONSALVE,S.ROSSELLI,M.BRUNO,A.BALDESSARI |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2106(2005) |
| Molecular Weight | 362.466 g/mol |
| Sample ID | 39259 |
| Solvent | CD3OD |