| SpectraBase Compound ID | E5m5AcBM7Q |
|---|---|
| InChI | InChI=1S/C8H11NO/c1-4-6-8(10)9(3)7-5-2/h5H,2,7H2,1,3H3 |
| InChIKey | SKDVCJMDGUEVPP-UHFFFAOYSA-N |
| Mol Weight | 137.18 g/mol |
| Molecular Formula | C8H11NO |
| Exact Mass | 137.084064 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BbdHuUAuYqV |
|---|---|
| Name | N-Allyl-N-methyl 2-butynamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 137.084063977 u |
| Formula | C8H11NO |
| InChI | InChI=1S/C8H11NO/c1-4-6-8(10)9(3)7-5-2/h5H,2,7H2,1,3H3 |
| InChIKey | SKDVCJMDGUEVPP-UHFFFAOYSA-N |
| Molecular Weight | 137.182 g/mol |
| Nominal Mass | 137 u |
| SMILES | C(C#CC)(N(CC=C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840737 |