| SpectraBase Compound ID | GzbodjmRdae |
|---|---|
| InChI | InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21-,22+,23-,24+,25-,27-,28+,29-,30-/m1/s1 |
| InChIKey | XWMMEBCFHUKHEX-ZJJHUPNDSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5YOHkUFYUeh |
|---|---|
| Name | Taraxasterol |
| Carrier Gas | Nitrogen (2 mL/min) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O |
| GC Oven Program | Oven temp 200oC |
| InChI | InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21-,22+,23-,24+,25-,27-,28+,29-,30-/m1/s1 |
| InChIKey | XWMMEBCFHUKHEX-ZJJHUPNDSA-N |
| Instrument Name | Fisons GC 8000-MD 800 |
| Ionization Type | EI Positive ion |
| Literature Reference DOI | 10.1002/jssc.200600253 |
| Molecular Weight | 426.729 g/mol |
| Quality | 585 |
| SMILES | O[C@]1(CC[C@]2([C@](C1(C)C)(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@@]1([C@@]2([C@@](C(CC1)=C)(C)[H])[H])C)C)[H])[H])C)[H])C)[H] |
| SPLASH | splash10-0a4r-8930000000-688d66523bb0a6abd259 |
| Source of Spectrum | SEP-30-750-Taraxasterol (DOI: 10.1002/jssc.200600253) |
| Wiley ID | 1907944 |