| SpectraBase Compound ID | 23RNsvVOFyA |
|---|---|
| InChI | InChI=1S/C9H16BrNO/c1-7(10)9(2,3)6-4-5-8(11)12/h1,4-6H2,2-3H3,(H2,11,12) |
| InChIKey | JMDCJHGJVZSNAV-UHFFFAOYSA-N |
| Mol Weight | 234.14 g/mol |
| Molecular Formula | C9H16BrNO |
| Exact Mass | 233.041527 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LRMJkN2A2Kf |
|---|---|
| Name | 6-Bromo-5,5-dimethylhept-6-enamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.041527138 u |
| Formula | C9H16BrNO |
| InChI | InChI=1S/C9H16BrNO/c1-7(10)9(2,3)6-4-5-8(11)12/h1,4-6H2,2-3H3,(H2,11,12) |
| InChIKey | JMDCJHGJVZSNAV-UHFFFAOYSA-N |
| Molecular Weight | 234.137 g/mol |
| SMILES | C(CCC(N)=O)C(C(=C)Br)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955023 |