| SpectraBase Compound ID | 3anPCSGeYW6 |
|---|---|
| InChI | InChI=1S/C25H34O7/c1-5-6-7-19-20(10-8-18(31-16(2)26)9-11-23(29)30-4)25-21(19)12-14-24(25,32-17(3)27)15-13-22(25)28/h8,10,13,15,18-21H,5-7,9,11-12,14H2,1-4H3/b10-8+/t18-,19-,20+,21+,24-,25-/m0/s1 |
| InChIKey | GNUQDKRCUAQQRE-RCVMNBAESA-N |
| Mol Weight | 446.5 g/mol |
| Molecular Formula | C25H34O7 |
| Exact Mass | 446.230453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BeicwxFtPIJ |
|---|---|
| Name | TRICYCLOCLAVULONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O7 |
| InChI | InChI=1S/C25H34O7/c1-5-6-7-19-20(10-8-18(31-16(2)26)9-11-23(29)30-4)25-21(19)12-14-24(25,32-17(3)27)15-13-22(25)28/h8,10,13,15,18-21H,5-7,9,11-12,14H2,1-4H3/b10-8+/t18-,19-,20+,21+,24-,25-/m0/s1 |
| InChIKey | GNUQDKRCUAQQRE-RCVMNBAESA-N |
| Literature Reference Author | M.IWASHIMA,I.TERADA,K.OKAMOTO,K.IGUCHI |
| Literature Reference Citation | J.ORG.CHEM.,67,2977(2002) |
| Literature Reference DOI | 10.1021/jo011043g |
| Molecular Weight | 446.541 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS23863 |