SpectraBase Compound ID | GbgAZyuxcHa |
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InChI | InChI=1S/C11H22ClNO/c1-4-6-7-8-9(3)13-11(14)10(12)5-2/h9-10H,4-8H2,1-3H3,(H,13,14) |
InChIKey | HZGYQIVHPLTFLI-UHFFFAOYSA-N |
Mol Weight | 219.76 g/mol |
Molecular Formula | C11H22ClNO |
Exact Mass | 219.138992 g/mol |
SpectraBase Spectrum ID | 9F8KeIfCk6S |
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Name | Butyramide, 2-chloro-N-hept-2-yl- |
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/c1-4-6-7-8-9(3)13-11(14)10(12)5-2/h9-10H,4-8H2,1-3H3,(H,13,14) |
InChIKey | HZGYQIVHPLTFLI-UHFFFAOYSA-N |
Molecular Weight | 219.756 g/mol |
SMILES | C(=O)(NC(CCCCC)C)C(CC)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953837 |