| SpectraBase Compound ID | 6IsKuydQNud |
|---|---|
| InChI | InChI=1S/C14H18O4/c1-16-9-5-8-13-12(15)10-17-14(18-13)11-6-3-2-4-7-11/h2-7,9,12-15H,8,10H2,1H3/b9-5+ |
| InChIKey | IWFFYBZFEDYIOT-WEVVVXLNSA-N |
| Mol Weight | 250.29 g/mol |
| Molecular Formula | C14H18O4 |
| Exact Mass | 250.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FS8cGjnq5Cp |
|---|---|
| Name | (E)-4,6-o-Benzylidene-2,3-dideoxy-1-o-methylhex-1-enitol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.120509056 u |
| Formula | C14H18O4 |
| InChI | InChI=1S/C14H18O4/c1-16-9-5-8-13-12(15)10-17-14(18-13)11-6-3-2-4-7-11/h2-7,9,12-15H,8,10H2,1H3/b9-5+ |
| InChIKey | IWFFYBZFEDYIOT-WEVVVXLNSA-N |
| Molecular Weight | 250.294 g/mol |
| SMILES | C1(OC(C(CO1)O)C\C=C\OC)C1=CC=CC=C1 |