| SpectraBase Compound ID | 7wGqfoUF8BY |
|---|---|
| InChI | InChI=1S/C21H31ClO5/c1-13-6-9-20-15(19(13,2)8-7-14-10-17(23)26-11-14)4-5-16(22)21(20,24)12-27-18(20)25-3/h10,13,15-16,18,24H,4-9,11-12H2,1-3H3/t13-,15-,16+,18-,19+,20+,21-/m0/s1 |
| InChIKey | NAYPHLPWUYNNEZ-SZJWAJFPSA-N |
| Mol Weight | 398.93 g/mol |
| Molecular Formula | C21H31ClO5 |
| Exact Mass | 398.186002 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IapOgD92hXX |
|---|---|
| Name | GUTIEROLIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31ClO5 |
| InChI | InChI=1S/C21H31ClO5/c1-13-6-9-20-15(19(13,2)8-7-14-10-17(23)26-11-14)4-5-16(22)21(20,24)12-27-18(20)25-3/h10,13,15-16,18,24H,4-9,11-12H2,1-3H3/t13-,15-,16+,18-,19+,20+,21-/m0/s1 |
| InChIKey | NAYPHLPWUYNNEZ-SZJWAJFPSA-N |
| Literature Reference Author | F.M.HARRAZ,R.W.DOSKOTCH |
| Literature Reference Citation | J.NAT.PROD.,53,1312(1990) |
| Literature Reference DOI | 10.1021/np50071a027 |
| Molecular Weight | 398.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU133 |