| SpectraBase Compound ID | BVV3b280jfz |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-13-7-5-8-14(2)11-17(21)16-12-18(24-19(22)15(16)3)20(4,23)10-6-9-13/h8-9,16-18,21,23H,3,5-7,10-12H2,1-2,4H3/b13-9+,14-8+/t16-,17-,18+,20+/m0/s1 |
| InChIKey | GQCXSSWGCFPUBF-BVLQWSETSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 44FYBOmySQv |
|---|---|
| Name | Crassin alcohol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-13-7-5-8-14(2)11-17(21)16-12-18(24-19(22)15(16)3)20(4,23)10-6-9-13/h8-9,16-18,21,23H,3,5-7,10-12H2,1-2,4H3/b13-9+,14-8+/t16-,17-,18+,20+/m0/s1 |
| InChIKey | GQCXSSWGCFPUBF-BVLQWSETSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | O[C@]1([C@@]2(OC(C([C@@]([C@](C\C(=C\CC\C(=C\CC1)C)C)(O)[H])(C2)[H])=C)=O)[H])C |
| SPLASH | splash10-066u-9522000000-5ae4c624e7def43dcad3 |
| Source of Spectrum | J-66-654-10 |
| Wiley ID | 1534331 |