| SpectraBase Compound ID | 10gH0K1Kdzg |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-2-3-4-8-12(14)10-6-5-7-11(13)9-10/h5-7,9,12-14H,2-4,8H2,1H3 |
| InChIKey | IBFOMXXVRQYPGR-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AaA5EnVKfY6 |
|---|---|
| Name | 3-(1-Hydroxyhexyl)phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-2-3-4-8-12(14)10-6-5-7-11(13)9-10/h5-7,9,12-14H,2-4,8H2,1H3 |
| InChIKey | IBFOMXXVRQYPGR-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C=1(C=C(O)C=CC1)C(O)CCCCC |