| SpectraBase Compound ID | 29vyYUJIZ1K |
|---|---|
| InChI | InChI=1S/C11H16O/c1-4-8-12-11-9(2)6-5-7-10(11)3/h5-7H,4,8H2,1-3H3 |
| InChIKey | ORWYJYFTKGSHEU-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GeYwA10emup |
|---|---|
| Name | Benzene, 1,3-dimethyl-2-propoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-4-8-12-11-9(2)6-5-7-10(11)3/h5-7H,4,8H2,1-3H3 |
| InChIKey | ORWYJYFTKGSHEU-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C1=CC(C)=C(C(=C1)C)OCCC |