SpectraBase Compound ID | 4ftabjfDqHv |
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InChI | InChI=1S/C10H20ClNO/c1-9(2)8-12-10(13)6-4-3-5-7-11/h9H,3-8H2,1-2H3,(H,12,13) |
InChIKey | ONIDGJVNBXPAOL-UHFFFAOYSA-N |
Mol Weight | 205.73 g/mol |
Molecular Formula | C10H20ClNO |
Exact Mass | 205.123342 g/mol |
SpectraBase Spectrum ID | 4FaEfEhFUka |
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Name | Hexanamide, 6-chloro-N-isobutyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 205.123341967 u |
Formula | C10H20ClNO |
InChI | InChI=1S/C10H20ClNO/c1-9(2)8-12-10(13)6-4-3-5-7-11/h9H,3-8H2,1-2H3,(H,12,13) |
InChIKey | ONIDGJVNBXPAOL-UHFFFAOYSA-N |
Molecular Weight | 205.729 g/mol |
SMILES | C(CCCCCCl)(NCC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.934982 |