| SpectraBase Compound ID | 8RFM3BWTAD0 |
|---|---|
| InChI | InChI=1S/C12H25NO/c1-6-7-13-11(14)8-10(2)9-12(3,4)5/h10H,6-9H2,1-5H3,(H,13,14) |
| InChIKey | XBQUXGRLIYHPFK-UHFFFAOYSA-N |
| Mol Weight | 199.34 g/mol |
| Molecular Formula | C12H25NO |
| Exact Mass | 199.193614 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FADgvjSNxts |
|---|---|
| Name | Hexanamide, 3,5,5-trimethyl-N-propyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.193614428 u |
| Formula | C12H25NO |
| InChI | InChI=1S/C12H25NO/c1-6-7-13-11(14)8-10(2)9-12(3,4)5/h10H,6-9H2,1-5H3,(H,13,14) |
| InChIKey | XBQUXGRLIYHPFK-UHFFFAOYSA-N |
| Molecular Weight | 199.338 g/mol |
| SMILES | C(=O)(NCCC)CC(CC(C)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892291 |