| SpectraBase Compound ID | 9hXg16kBOt3 |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-4-6-7-11-15-19(16(3)12-5-2)18(20)17-13-9-8-10-14-17/h8-10,13-14,16H,4-7,11-12,15H2,1-3H3 |
| InChIKey | VNXTVHXUEKZSDR-UHFFFAOYSA-N |
| Mol Weight | 275.44 g/mol |
| Molecular Formula | C18H29NO |
| Exact Mass | 275.224915 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4zF0p8ULHmP |
|---|---|
| Name | Benzamide, N-(2-pentyl)-N-hexyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.224914557 u |
| Formula | C18H29NO |
| InChI | InChI=1S/C18H29NO/c1-4-6-7-11-15-19(16(3)12-5-2)18(20)17-13-9-8-10-14-17/h8-10,13-14,16H,4-7,11-12,15H2,1-3H3 |
| InChIKey | VNXTVHXUEKZSDR-UHFFFAOYSA-N |
| SMILES | CCCC(N(C(=O)C=1C=CC=CC1)CCCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.92488 |