| SpectraBase Compound ID | CSA0a7GZ0Un |
|---|---|
| InChI | InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21?,24-,25-,26+,27-,28+/m1/s1 |
| InChIKey | LLINHWDEBZOLGN-QYENANPWSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C28H36O4 |
| Exact Mass | 436.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KxYAScE2apU |
|---|---|
| Name | 20-HYDROXY-20-EPI-TINGENONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H36O4 |
| InChI | InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21?,24-,25-,26+,27-,28+/m1/s1 |
| InChIKey | LLINHWDEBZOLGN-QYENANPWSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |