| SpectraBase Compound ID | 8NnT22qEOb3 |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3/i3D3 |
| InChIKey | DCKVNWZUADLDEH-HPRDVNIFSA-N |
| Mol Weight | 119.18 g/mol |
| Molecular Formula | C6H9D3O2 |
| Exact Mass | 119.10256 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | dyyqFPXEWH |
|---|---|
| Name | Acetic-D3 acid, 1-methylpropyl ester |
| CAS Registry Number | 53897-35-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H9D3O2 |
| InChI | InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3/i3D3 |
| InChIKey | DCKVNWZUADLDEH-HPRDVNIFSA-N |
| Molecular Weight | 119.178 g/mol |
| SMILES | C(=O)(OC(CC)C)C([D])([D])[D] |
| SPLASH | splash10-052b-9000000000-02b73a92757e38ff064e |
| Source of Spectrum | AA-0-471-2 |
| Synonyms | sec-butyl 2,2,2-D3-acetate |
| Wiley ID | 1125766 |