![Propanol, [(butoxymethylethoxy)methylethoxy]-](/api/spectrum/NNTlDIcRCD/structure.png?h=300&w=458 "Propanol, [(butoxymethylethoxy)methylethoxy]-")
| SpectraBase Compound ID | HQMbUSnSxZx |
|---|---|
| InChI | InChI=1S/C13H28O4/c1-5-6-7-15-9-12(3)17-10-13(4)16-8-11(2)14/h11-14H,5-10H2,1-4H3 |
| InChIKey | LORVPHHKJFSORQ-UHFFFAOYSA-N |
| Mol Weight | 248.36 g/mol |
| Molecular Formula | C13H28O4 |
| Exact Mass | 248.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | NNTlDIcRCD |
|---|---|
| Name | Propanol, [(butoxymethylethoxy)methylethoxy]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.198759378 u |
| Formula | C13H28O4 |
| InChI | InChI=1S/C13H28O4/c1-5-6-7-15-9-12(3)17-10-13(4)16-8-11(2)14/h11-14H,5-10H2,1-4H3 |
| InChIKey | LORVPHHKJFSORQ-UHFFFAOYSA-N |
| Molecular Weight | 248.363 g/mol |
| SMILES | CCCCOCC(OCC(OCC(O)C)C)C |