| SpectraBase Compound ID | 8QqAnPbrTbd |
|---|---|
| InChI | InChI=1S/C15H22O5/c1-15(2,3)20-13(16)9-10-7-11(17-4)14(19-6)12(8-10)18-5/h7-8H,9H2,1-6H3 |
| InChIKey | RTXUWSFXEGMJIS-UHFFFAOYSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C15H22O5 |
| Exact Mass | 282.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CIvYF4JSUxO |
|---|---|
| Name | (3,4,5-Trimethoxyphenyl)acetic acid, tert-butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.146723803 u |
| Formula | C15H22O5 |
| InChI | InChI=1S/C15H22O5/c1-15(2,3)20-13(16)9-10-7-11(17-4)14(19-6)12(8-10)18-5/h7-8H,9H2,1-6H3 |
| InChIKey | RTXUWSFXEGMJIS-UHFFFAOYSA-N |
| SMILES | C1(=C(C=C(CC(OC(C)(C)C)=O)C=C1OC)OC)OC |