| SpectraBase Compound ID | 4P8PmdBWH6a |
|---|---|
| InChI | InChI=1S/C18H26O11/c1-6-10(27-7(2)20)3-8-9(16(24)25)5-26-17(12(6)8)29-18-15(23)14(22)13(21)11(4-19)28-18/h5-6,8,10-15,17-19,21-23H,3-4H2,1-2H3,(H,24,25)/t6-,8+,10-,11-,12+,13-,14+,15-,17-,18+/m0/s1 |
| InChIKey | PYRKTZSRUCICCL-CINNJXFQSA-N |
| Mol Weight | 418.4 g/mol |
| Molecular Formula | C18H26O11 |
| Exact Mass | 418.147512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FqgmLnUzEGT |
|---|---|
| Name | 7-O-ACETYL-LOGANIC_ACID |
| Compound Number | 178 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H26O11 |
| InChI | InChI=1S/C18H26O11/c1-6-10(27-7(2)20)3-8-9(16(24)25)5-26-17(12(6)8)29-18-15(23)14(22)13(21)11(4-19)28-18/h5-6,8,10-15,17-19,21-23H,3-4H2,1-2H3,(H,24,25)/t6-,8+,10-,11-,12+,13-,14+,15-,17-,18+/m0/s1 |
| InChIKey | PYRKTZSRUCICCL-CINNJXFQSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 418.398 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ16160 |