| SpectraBase Compound ID | Jf3pC1gfGXD |
|---|---|
| InChI | InChI=1S/C12H13NO/c1-9(2)12-13-8-11(14-12)10-6-4-3-5-7-10/h3-9H,1-2H3 |
| InChIKey | SWBMAYBXALFJKT-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C12H13NO |
| Exact Mass | 187.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zdXIPv6Nmf |
|---|---|
| Name | 2-Isopropyl-5-phenyloxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.099714042 u |
| Formula | C12H13NO |
| InChI | InChI=1S/C12H13NO/c1-9(2)12-13-8-11(14-12)10-6-4-3-5-7-10/h3-9H,1-2H3 |
| InChIKey | SWBMAYBXALFJKT-UHFFFAOYSA-N |
| Molecular Weight | 187.242 g/mol |
| SMILES | C=1(OC(=CN1)C=1C=CC=CC1)C(C)C |