| SpectraBase Compound ID | EwXFodzPMyy |
|---|---|
| InChI | InChI=1S/C17H26O4/c1-13(10-20-11-14-8-6-5-7-9-14)15(18)12-21-16(19)17(2,3)4/h5-9,13,15,18H,10-12H2,1-4H3/t13-,15+/m0/s1 |
| InChIKey | JCANSGZWDNZXRZ-DZGCQCFKSA-N |
| Mol Weight | 294.39 g/mol |
| Molecular Formula | C17H26O4 |
| Exact Mass | 294.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8vLrCZ8gwNr |
|---|---|
| Name | (2S,3S)-4-(Benzyloxy)-2-hydroxy-3-methylbutyl pivalate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.183109313 u |
| Formula | C17H26O4 |
| InChI | InChI=1S/C17H26O4/c1-13(10-20-11-14-8-6-5-7-9-14)15(18)12-21-16(19)17(2,3)4/h5-9,13,15,18H,10-12H2,1-4H3/t13-,15+/m0/s1 |
| InChIKey | JCANSGZWDNZXRZ-DZGCQCFKSA-N |
| SMILES | C(C(C)(C)C)(OC[C@]([C@](COCC=1C=CC=CC1)(C)[H])(O)[H])=O |