| SpectraBase Compound ID | 60j3GfVQtVw |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-13-10-20-11-14(13)5-6-15(20)19(3)8-4-7-18(2,12-21)16(19)9-17(20)22/h14-17,21-22H,1,4-12H2,2-3H3/t14-,15+,16-,17-,18-,19+,20+/m1/s1 |
| InChIKey | AMOBKAMJSKCUFH-IRIQXGSBSA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AU0plRl30eh |
|---|---|
| Name | 7.alpha.,18-dihydroxy-ent-kaur-16-ene |
| Alternate Name(s) | Candicandiol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-13-10-20-11-14(13)5-6-15(20)19(3)8-4-7-18(2,12-21)16(19)9-17(20)22/h14-17,21-22H,1,4-12H2,2-3H3/t14-,15+,16-,17-,18-,19+,20+/m1/s1 |
| InChIKey | AMOBKAMJSKCUFH-IRIQXGSBSA-N |
| Instrument Name | Micromass Autospec |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np020420x |
| Molecular Weight | 304.474 g/mol |
| Reported Formula | C20H32O2 |
| SMILES | OC[C@]1(CCC[C@]2([C@]3([C@@]4([C@@](C[C@]12[H])(O)[H])C[C@@](CC3)(C(C4)=C)[H])[H])C)C |
| SPLASH | splash10-0pvs-0492000000-f8e3d150c64410f2664a |
| Source of Spectrum | G4-66-329-2 |
| Wiley ID | 1881275 |