SpectraBase Compound ID | Ek3G9KSxkR7 |
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InChI | InChI=1S/C11H14O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/i8D,9D2 |
InChIKey | JAGZUIGGHGTFHO-VWQYXNFYSA-N |
Mol Weight | 181.25 g/mol |
Molecular Formula | C11H112D3O2 |
Exact Mass | 181.11821 g/mol |
SpectraBase Spectrum ID | XnbfIdomG |
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Name | Ethyl 2,2,3-trideuterio-3-phenylpropanoate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H11D3O2 |
InChI | InChI=1S/C11H14O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/i8D,9D2 |
InChIKey | JAGZUIGGHGTFHO-VWQYXNFYSA-N |
Molecular Weight | 181.249 g/mol |
SMILES | C(C(C(c1ccccc1)[2D])([2D])[2D])(=O)OCC |
SPLASH | splash10-0a4i-4900000000-0c06d602a3634b90a07d |
Source of Spectrum | F-70-4719-9 |
Wiley ID | 1597052 |