| SpectraBase Compound ID | 40jV1STn2Ym |
|---|---|
| InChI | InChI=1S/C16H24O/c1-6-7-12(2)15(17)13-8-10-14(11-9-13)16(3,4)5/h6-12,15,17H,1-5H3/b7-6+ |
| InChIKey | QLDJXKONNWSURF-VOTSOKGWSA-N |
| Mol Weight | 232.37 g/mol |
| Molecular Formula | C16H24O |
| Exact Mass | 232.182715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GN1vi5Ss0N3 |
|---|---|
| Name | 1-(4-Tert-butyl)phenyl-2-methyl-3-pentenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.182715392 u |
| Formula | C16H24O |
| InChI | InChI=1S/C16H24O/c1-6-7-12(2)15(17)13-8-10-14(11-9-13)16(3,4)5/h6-12,15,17H,1-5H3/b7-6+ |
| InChIKey | QLDJXKONNWSURF-VOTSOKGWSA-N |
| Molecular Weight | 232.367 g/mol |
| SMILES | C(C1=CC=C(C=C1)C(C(\C=C\C)C)O)(C)(C)C |