| SpectraBase Compound ID | FI6ufS2CYz5 |
|---|---|
| InChI | InChI=1S/C16H26O4/c1-3-15(9-17)16(18)13(2)10-19-12-20-11-14-7-5-4-6-8-14/h4-8,13,15-18H,3,9-12H2,1-2H3/t13-,15-,16-/m0/s1 |
| InChIKey | CSILOCZAGDNCMC-BPUTZDHNSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C16H26O4 |
| Exact Mass | 282.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J7itPsAwItV |
|---|---|
| Name | (2S,3S,4S)-5-Benzyloxymethoxy-2-ethyl-4-methylpentane-1,3-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.183109313 u |
| Formula | C16H26O4 |
| InChI | InChI=1S/C16H26O4/c1-3-15(9-17)16(18)13(2)10-19-12-20-11-14-7-5-4-6-8-14/h4-8,13,15-18H,3,9-12H2,1-2H3/t13-,15-,16-/m0/s1 |
| InChIKey | CSILOCZAGDNCMC-BPUTZDHNSA-N |
| SMILES | [C@@]([C@](COCOCC=1C=CC=CC1)(C)[H])([C@](CO)(CC)[H])(O)[H] |