SpectraBase Compound ID | Dzaq8UrnDRm |
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InChI | InChI=1S/C11H22ClNO/c1-2-3-7-10-13-11(14)8-5-4-6-9-12/h2-10H2,1H3,(H,13,14) |
InChIKey | WRUGPIIWZAITMR-UHFFFAOYSA-N |
Mol Weight | 219.76 g/mol |
Molecular Formula | C11H22ClNO |
Exact Mass | 219.138992 g/mol |
SpectraBase Spectrum ID | K4wyGSs6cUW |
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Name | Hexanamide, 6-chloro-N-pentyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 219.138992031 u |
Formula | C11H22ClNO |
InChI | InChI=1S/C11H22ClNO/c1-2-3-7-10-13-11(14)8-5-4-6-9-12/h2-10H2,1H3,(H,13,14) |
InChIKey | WRUGPIIWZAITMR-UHFFFAOYSA-N |
Molecular Weight | 219.756 g/mol |
SMILES | C(CCCCCCl)(NCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962641 |