| SpectraBase Compound ID | C0Zsp1PY9rn |
|---|---|
| InChI | InChI=1S/C6H12O3/c1-2-3-9-6(4-7)5-8/h2,6-8H,1,3-5H2 |
| InChIKey | IGDCJKDZZUALAO-UHFFFAOYSA-N |
| Mol Weight | 132.16 g/mol |
| Molecular Formula | C6H12O3 |
| Exact Mass | 132.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 26l3JsdtxDb |
|---|---|
| Name | 1,3-Propanediol, 2-(2-propenyloxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.078644243 u |
| Formula | C6H12O3 |
| InChI | InChI=1S/C6H12O3/c1-2-3-9-6(4-7)5-8/h2,6-8H,1,3-5H2 |
| InChIKey | IGDCJKDZZUALAO-UHFFFAOYSA-N |
| SMILES | C(=C)COC(CO)CO |