SpectraBase Compound ID | 4wo2n4jqMWu |
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InChI | InChI=1S/C8H16ClNO/c1-4-10(6-7(2)3)8(11)5-9/h7H,4-6H2,1-3H3 |
InChIKey | NFYZIEFIGBHLBZ-UHFFFAOYSA-N |
Mol Weight | 177.67 g/mol |
Molecular Formula | C8H16ClNO |
Exact Mass | 177.092042 g/mol |
SpectraBase Spectrum ID | LTrhq1Jnnu1 |
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Name | Chloroacetamide, N-ethyl-N-isobutyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.092041838 u |
Formula | C8H16ClNO |
InChI | InChI=1S/C8H16ClNO/c1-4-10(6-7(2)3)8(11)5-9/h7H,4-6H2,1-3H3 |
InChIKey | NFYZIEFIGBHLBZ-UHFFFAOYSA-N |
Molecular Weight | 177.675 g/mol |
SMILES | C(CCl)(=O)N(CC(C)C)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965437 |