| SpectraBase Compound ID | FOGxaWfcDaK |
|---|---|
| InChI | InChI=1S/C29H46O/c1-18(2)19(3)8-9-20(4)23-12-13-25-22-10-11-24-21(5)27(30)15-17-29(24,7)26(22)14-16-28(23,25)6/h8-11,18-21,23-24,26-27,30H,12-17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24?,26-,27-,28+,29-/m0/s1 |
| InChIKey | JXWWITGIOCSBLV-RMQHYHMMSA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C29H46O |
| Exact Mass | 410.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LhDKsfKTYQc |
|---|---|
| Name | 4-ALPHA-METHYL-ERGOSTA-6,8(14),22E-TRIENE-3-BETA-OL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O |
| InChI | InChI=1S/C29H46O/c1-18(2)19(3)8-9-20(4)23-12-13-25-22-10-11-24-21(5)27(30)15-17-29(24,7)26(22)14-16-28(23,25)6/h8-11,18-21,23-24,26-27,30H,12-17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24?,26-,27-,28+,29-/m0/s1 |
| InChIKey | JXWWITGIOCSBLV-RMQHYHMMSA-N |
| Literature Reference Author | T.ISHII,H.MATSUURA,Z.ZHAOQI,C.S.VAIRAPPAN |
| Literature Reference Citation | MOLECULES,14,3360(2009) |
| Literature Reference DOI | 10.3390/molecules14093360 |
| Molecular Weight | 410.684 g/mol |
| Sample ID | 69699 |
| Solvent | CDCl3 |