| SpectraBase Compound ID | IHvHo0IIUiP |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3/i4D2 |
| InChIKey | DKPFZGUDAPQIHT-APZFVMQVSA-N |
| Mol Weight | 118.17 g/mol |
| Molecular Formula | C6H10D2O2 |
| Exact Mass | 118.096283 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3DIzzvkg46Z |
|---|---|
| Name | 1-Butan-2,2-D2-ol, acetate |
| Alternate Name(s) | 1,1-D2-n-butyl acetate |
| CAS Registry Number | 53897-37-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10D2O2 |
| InChI | InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3/i4D2 |
| InChIKey | DKPFZGUDAPQIHT-APZFVMQVSA-N |
| Molecular Weight | 118.172 g/mol |
| SMILES | C(=O)(OCC(CC)([D])[D])C |
| SPLASH | splash10-0006-9000000000-ac2e5a22aa39f41b9372 |
| Source of Spectrum | AA-0-464-2 |
| Wiley ID | 3513 |