| SpectraBase Compound ID | 2nX2Aa8Tqjr |
|---|---|
| InChI | InChI=1S/C9H16O5/c1-9(12,8(11)14-3)6-4-5-7(10)13-2/h12H,4-6H2,1-3H3/t9-/m0/s1 |
| InChIKey | CQDRMSKSJGMNIA-VIFPVBQESA-N |
| Mol Weight | 204.22 g/mol |
| Molecular Formula | C9H16O5 |
| Exact Mass | 204.099774 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EUCoRCvFQFr |
|---|---|
| Name | Dimethyl (2S)-2-Hydroxy-2-methylhexanedioate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O5 |
| InChI | InChI=1S/C9H16O5/c1-9(12,8(11)14-3)6-4-5-7(10)13-2/h12H,4-6H2,1-3H3/t9-/m0/s1 |
| InChIKey | CQDRMSKSJGMNIA-VIFPVBQESA-N |
| Molecular Weight | 204.222 g/mol |
| SMILES | O[C@](C(=O)OC)(CCCC(=O)OC)C |
| SPLASH | splash10-03du-8900000000-6e9e1507d9c6180592e6 |
| Source of Spectrum | F4-40-2108-7 |
| Wiley ID | 1670743 |