| SpectraBase Compound ID | 5MBV41K1LJR |
|---|---|
| InChI | InChI=1S/C6H12O/c1-3-4-5-6-7-2/h3-4H,5-6H2,1-2H3/b4-3+ |
| InChIKey | IYFJMSOPJUQBSR-ONEGZZNKSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kzt3fELuTbh |
|---|---|
| Name | E-1-Methoxy-3-pentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 100.088815005 u |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-3-4-5-6-7-2/h3-4H,5-6H2,1-2H3/b4-3+ |
| InChIKey | IYFJMSOPJUQBSR-ONEGZZNKSA-N |
| Molecular Weight | 100.161 g/mol |
| SMILES | COCC\C=C\C |