| SpectraBase Compound ID | Eet7I6jOjNh |
|---|---|
| InChI | InChI=1S/C13H16O4/c1-13(2,3)17-12(15)9-16-11-6-4-5-10(7-11)8-14/h4-8H,9H2,1-3H3 |
| InChIKey | IOHGZBLANANFDS-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C13H16O4 |
| Exact Mass | 236.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L0sRQ6KIy8X |
|---|---|
| Name | T-Butyl 2-(3'-formylphenoxy)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.104858991 u |
| Formula | C13H16O4 |
| InChI | InChI=1S/C13H16O4/c1-13(2,3)17-12(15)9-16-11-6-4-5-10(7-11)8-14/h4-8H,9H2,1-3H3 |
| InChIKey | IOHGZBLANANFDS-UHFFFAOYSA-N |
| Molecular Weight | 236.267 g/mol |
| SMILES | C(OC(C)(C)C)(=O)COC=1C=C(C=O)C=CC1 |