| SpectraBase Compound ID | 411UhbJXEJz |
|---|---|
| InChI | InChI=1S/C31H44O/c1-28(2,3)26-5-4-6-27(13-26)31(32,29-14-20-7-21(15-29)9-22(8-20)16-29)30-17-23-10-24(18-30)12-25(11-23)19-30/h4-6,13,20-25,32H,7-12,14-19H2,1-3H3/t20-,21+,22-,23-,24+,25-,29-,30- |
| InChIKey | STCGZNCMHNCCQB-UIYLZVDKSA-N |
| Mol Weight | 432.7 g/mol |
| Molecular Formula | C31H44O |
| Exact Mass | 432.339216 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ETSgmfRluKe |
|---|---|
| Name | anti-DI-(1-ADAMANTYL)-m-(tert-BUTYL)-PHENYLMETHANOL |
| Compound Number | 7A |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C31H44O/c1-28(2,3)26-5-4-6-27(13-26)31(32,29-14-20-7-21(15-29)9-22(8-20)16-29)30-17-23-10-24(18-30)12-25(11-23)19-30/h4-6,13,20-25,32H,7-12,14-19H2,1-3H3/t20-,21+,22-,23-,24+,25-,29-,30- |
| InChIKey | STCGZNCMHNCCQB-UIYLZVDKSA-N |
| Literature Reference | J.CHEM.SOC.PERKIN-2,459(1994) J.S.LOMAS,V.BRU-CAPDEVILLE |
| Solvent | Chloroform-d |