| SpectraBase Compound ID | 815JD9L5QgP |
|---|---|
| InChI | InChI=1S/C12H25NO/c1-4-6-7-8-10-13-12(14)11(3)9-5-2/h11H,4-10H2,1-3H3,(H,13,14) |
| InChIKey | BIYPXNKBAWBODG-UHFFFAOYSA-N |
| Mol Weight | 199.34 g/mol |
| Molecular Formula | C12H25NO |
| Exact Mass | 199.193614 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AsbqFmkFH8x |
|---|---|
| Name | Valeramide, 2-methyl-N-hexyl- |
| 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/c1-4-6-7-8-10-13-12(14)11(3)9-5-2/h11H,4-10H2,1-3H3,(H,13,14) |
| InChIKey | BIYPXNKBAWBODG-UHFFFAOYSA-N |
| Molecular Weight | 199.338 g/mol |
| SMILES | C(=O)(NCCCCCC)C(CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.922705 |