| SpectraBase Compound ID | 8wJquZ7fi3 |
|---|---|
| InChI | InChI=1S/C22H34O4/c1-15(11-14-26-17(3)23)7-9-18-16(2)8-10-19-21(18,4)12-6-13-22(19,5)20(24)25/h11,18-19H,2,6-10,12-14H2,1,3-5H3,(H,24,25)/b15-11+/t18-,19+,21+,22-/m0/s1 |
| InChIKey | HSANNLXBHKRHSH-LMUCYUMOSA-N |
| Mol Weight | 362.5 g/mol |
| Molecular Formula | C22H34O4 |
| Exact Mass | 362.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Py5AEHBlfG |
|---|---|
| Name | ACETYL-ISOCUPRESSIC-ACID |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H34O4 |
| InChI | InChI=1S/C22H34O4/c1-15(11-14-26-17(3)23)7-9-18-16(2)8-10-19-21(18,4)12-6-13-22(19,5)20(24)25/h11,18-19H,2,6-10,12-14H2,1,3-5H3,(H,24,25)/b15-11+/t18-,19+,21+,22-/m0/s1 |
| InChIKey | HSANNLXBHKRHSH-LMUCYUMOSA-N |
| Literature Reference Author | M.P.POPOVA,I.B.CHINOU,I.N.MAREKOV,V.S.BANKOVA |
| Literature Reference Citation | PHYTOCHEM.,70,1262(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.07.025 |
| Molecular Weight | 362.510 g/mol |
| Sample ID | 45576 |
| Solvent | CDCl3 |