| SpectraBase Compound ID | ErpdCOStf95 |
|---|---|
| InChI | InChI=1S/C18H24O2/c1-19-16-4-3-15(8-17(16)20-2)18-9-12-5-13(10-18)7-14(6-12)11-18/h3-4,8,12-14H,5-7,9-11H2,1-2H3/t12-,13+,14-,18- |
| InChIKey | TZGWWYVUTYVFOG-WXZYKRPKSA-N |
| Mol Weight | 272.39 g/mol |
| Molecular Formula | C18H24O2 |
| Exact Mass | 272.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KVaOnI86DRM |
|---|---|
| Name | 1,2-Dimethoxy-4-(adamantyl-1)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.177630011 u |
| Formula | C18H24O2 |
| InChI | InChI=1S/C18H24O2/c1-19-16-4-3-15(8-17(16)20-2)18-9-12-5-13(10-18)7-14(6-12)11-18/h3-4,8,12-14H,5-7,9-11H2,1-2H3/t12-,13+,14-,18- |
| InChIKey | TZGWWYVUTYVFOG-WXZYKRPKSA-N |
| SMILES | [C@]12(CC3(C[C@](C2)(C[C@](C1)(C3)[H])[H])C=1C=C(C(=CC1)OC)OC)[H] |