| SpectraBase Compound ID | EAfdPCtJMVf |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-3-5-7-8-9-15-19-18(20)17-13-11-16(12-14-17)10-6-4-2/h11-14H,3-10,15H2,1-2H3,(H,19,20) |
| InChIKey | QKBLZZGDRVXPOG-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 | 9NJVp4TN4rx |
|---|---|
| Name | Benzamide, 4-butyl-N-heptyl- |
| 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/c1-3-5-7-8-9-15-19-18(20)17-13-11-16(12-14-17)10-6-4-2/h11-14H,3-10,15H2,1-2H3,(H,19,20) |
| InChIKey | QKBLZZGDRVXPOG-UHFFFAOYSA-N |
| SMILES | C(NCCCCCCC)(=O)C=1C=CC(=CC1)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981127 |