| SpectraBase Compound ID | HEK3HHCc3uz |
|---|---|
| InChI | InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14+,15-/m1/s1/i1+1,2+1,3+1,4+1,6+1,7+1,8+1,12+1,13+1 |
| InChIKey | RTONMYLSQISFQA-AILXMPGDSA-N |
| Mol Weight | 213.29 g/mol |
| Molecular Formula | C613C9H24 |
| Exact Mass | 213.217994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GeUIEI46rfx |
|---|---|
| Name | BETA-BARBATENE;1-C(13)-GLUCOSE-LABELLED |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C613C9H24 |
| InChI | InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14+,15-/m1/s1/i1+1,2+1,3+1,4+1,6+1,7+1,8+1,12+1,13+1 |
| InChIKey | RTONMYLSQISFQA-AILXMPGDSA-N |
| Literature Reference Author | U.WARMERS,W.A.KOENIG |
| Literature Reference Citation | PHYTOCHEM.,53,645(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00587-7 |
| Molecular Weight | 213.287 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU2088 |