| SpectraBase Compound ID | 6zXn5ypLVoc |
|---|---|
| InChI | InChI=1S/C15H18O3/c1-9-3-5-14(2)12-10-4-6-17-11(10)7-15(9,14)8-18-13(12)16/h4,6,9,12H,3,5,7-8H2,1-2H3/t9-,12+,14+,15-/m1/s1 |
| InChIKey | BLBXGSKOYPSCNN-WNPSNZDDSA-N |
| Mol Weight | 246.31 g/mol |
| Molecular Formula | C15H18O3 |
| Exact Mass | 246.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2n45WIoTcpK |
|---|---|
| Name | GRANDILOBALIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H18O3 |
| InChI | InChI=1S/C15H18O3/c1-9-3-5-14(2)12-10-4-6-17-11(10)7-15(9,14)8-18-13(12)16/h4,6,9,12H,3,5,7-8H2,1-2H3/t9-,12+,14+,15-/m1/s1 |
| InChIKey | BLBXGSKOYPSCNN-WNPSNZDDSA-N |
| Literature Reference Author | H.TAZAKI,F.ISHIKAWA,H.SOUTOME,K.NABETA |
| Literature Reference Citation | PHYTOCHEM.,48,851(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00983-7 |
| Molecular Weight | 246.306 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS1241 |