SpectraBase Compound ID | AymffRltLfu |
---|---|
InChI | InChI=1S/C5H8ClNO/c6-3-5(8)7-4-1-2-4/h4H,1-3H2,(H,7,8) |
InChIKey | ZPWIVSGEQGESFF-UHFFFAOYSA-N |
Mol Weight | 133.58 g/mol |
Molecular Formula | C5H8ClNO |
Exact Mass | 133.029442 g/mol |
SpectraBase Spectrum ID | 6Chv5bsXOwB |
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Name | 2-Chloro-N-cyclopropylacetamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 133.029441581 u |
Formula | C5H8ClNO |
InChI | InChI=1S/C5H8ClNO/c6-3-5(8)7-4-1-2-4/h4H,1-3H2,(H,7,8) |
InChIKey | ZPWIVSGEQGESFF-UHFFFAOYSA-N |
Molecular Weight | 133.578 g/mol |
SMILES | N(C(CCl)=O)C1CC1 |
Spectrum/Structure Validation Score (Raman) | 0.733213 |