| SpectraBase Compound ID | IhWMPay9uPB |
|---|---|
| InChI | InChI=1S/C22H34O7/c1-11-13-6-7-14-18(26)22(13,10-21(14,5)28)9-15(24)19(27)20(3,4)17(25)8-16(11)29-12(2)23/h13-18,24-26,28H,1,6-10H2,2-5H3/t13-,14-,15?,16?,17?,18-,21-,22+/m0/s1 |
| InChIKey | VLUUURQRFPOITF-UWUGDCTASA-N |
| Mol Weight | 410.5 g/mol |
| Molecular Formula | C22H34O7 |
| Exact Mass | 410.230453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AKcpAQW1ZDX |
|---|---|
| Name | 1-O-Acetyl-(6R)-grayanol B |
| CAS Registry Number | 78204-68-9 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C22H34O7 |
| InChI | InChI=1S/C22H34O7/c1-11-13-6-7-14-18(26)22(13,10-21(14,5)28)9-15(24)19(27)20(3,4)17(25)8-16(11)29-12(2)23/h13-18,24-26,28H,1,6-10H2,2-5H3/t13-,14-,15?,16?,17?,18-,21-,22+/m0/s1 |
| InChIKey | VLUUURQRFPOITF-UWUGDCTASA-N |
| Literature Reference | T. Kaiya, N. Shirai, J. Sakakibara, J. Chem. Soc. Chem. Comm. 22 (1981). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |