| SpectraBase Compound ID | FsHvb2aHnyC |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-5-10-16-13(15)17-12-9-7-6-8-11(12)14(2,3)4/h6-9H,5,10H2,1-4H3 |
| InChIKey | ROFJCNZKPVLJJD-UHFFFAOYSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C14H20O3 |
| Exact Mass | 236.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 41coMkVM943 |
|---|---|
| Name | 2-Tert-butylphenol, o-(N-propyloxycarbonyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.141244501 u |
| Formula | C14H20O3 |
| InChI | InChI=1S/C14H20O3/c1-5-10-16-13(15)17-12-9-7-6-8-11(12)14(2,3)4/h6-9H,5,10H2,1-4H3 |
| InChIKey | ROFJCNZKPVLJJD-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | C(C)(C)(C)C1=C(OC(OCCC)=O)C=CC=C1 |