| SpectraBase Compound ID | 4I8knMXlDUX |
|---|---|
| InChI | InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/i4D2 |
| InChIKey | NQPDZGIKBAWPEJ-APZFVMQVSA-N |
| Mol Weight | 104.15 g/mol |
| Molecular Formula | C5H8D2O2 |
| Exact Mass | 104.080633 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 51dKuLSGbm8 |
|---|---|
| Name | Pentanoic acid (dideuterated) |
| Alternate Name(s) | 2,2-Dideuteriopentanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8D2O2 |
| InChI | InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/i4D2 |
| InChIKey | NQPDZGIKBAWPEJ-APZFVMQVSA-N |
| Molecular Weight | 104.145 g/mol |
| SMILES | OC(C(CCC)([D])[D])=O |
| SPLASH | splash10-03fr-9000000000-428b0fb7b4803722d84b |
| Wiley ID | 1477225 |