| SpectraBase Compound ID | 67SVlQxZaPc |
|---|---|
| InChI | InChI=1S/C5H9NO/c1-2-3-4-6-5-7/h2-4H2,1H3 |
| InChIKey | HNHVTXYLRVGMHD-UHFFFAOYSA-N |
| Mol Weight | 99.13 g/mol |
| Molecular Formula | C5H9NO |
| Exact Mass | 99.068414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | BL2ZxS9ajFe |
|---|---|
| Name | Butyl isocyanate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | B95736 |
| CAS Registry Number | 111-36-4 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H9NO |
| InChI | 1S/C5H9NO/c1-2-3-4-6-5-7/h2-4H2,1H3 |
| InChIKey | HNHVTXYLRVGMHD-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 98% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_011007 |