| SpectraBase Compound ID | 8h7HBx7myZC |
|---|---|
| InChI | InChI=1S/C17H34ClNO/c1-5-7-8-12-16(4)19(15(3)11-6-2)17(20)13-9-10-14-18/h15-16H,5-14H2,1-4H3 |
| InChIKey | QUQAERQYPFHPJY-UHFFFAOYSA-N |
| Mol Weight | 303.9 g/mol |
| Molecular Formula | C17H34ClNO |
| Exact Mass | 303.232892 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | slrkh4SL2n |
|---|---|
| Name | Valeramide, 5-chloro-N-(2-pentyl)-N-(hept-2-yl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.232892418 u |
| Formula | C17H34ClNO |
| InChI | InChI=1S/C17H34ClNO/c1-5-7-8-12-16(4)19(15(3)11-6-2)17(20)13-9-10-14-18/h15-16H,5-14H2,1-4H3 |
| InChIKey | QUQAERQYPFHPJY-UHFFFAOYSA-N |
| SMILES | C(N(C(CCCCC)C)C(CCC)C)(=O)CCCCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.834254 |