| SpectraBase Compound ID | KAxLABKq91A |
|---|---|
| InChI | 1S/C7H12O/c1-3-4-5-7(2)6-8/h6H,2-5H2,1H3 |
| InChIKey | IWEWQGKFUYQGSN-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 7fetq0JEkHS |
|---|---|
| Name | 2-Butylacrolein |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 256137 |
| CAS Registry Number | 1070-66-2 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | 1S/C7H12O/c1-3-4-5-7(2)6-8/h6H,2-5H2,1H3 |
| InChIKey | IWEWQGKFUYQGSN-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 95% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | 2-Methylenehexanal |
| Wiley ID | SIAL_13CNMR_004485 |