SpectraBase Compound ID | EarLWKA5xU5 |
---|---|
InChI | InChI=1S/C12H16ClNO2/c1-16-11-7-5-10(6-8-11)14-12(15)4-2-3-9-13/h5-8H,2-4,9H2,1H3,(H,14,15) |
InChIKey | FBJIABNNCRFUEM-UHFFFAOYSA-N |
Mol Weight | 241.72 g/mol |
Molecular Formula | C12H16ClNO2 |
Exact Mass | 241.086956 g/mol |
SpectraBase Spectrum ID | LW4RsYP321s |
---|---|
Name | Pentanamide, N-(4-methoxyphenyl)-5-chloro- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 241.086956457 u |
Formula | C12H16ClNO2 |
InChI | InChI=1S/C12H16ClNO2/c1-16-11-7-5-10(6-8-11)14-12(15)4-2-3-9-13/h5-8H,2-4,9H2,1H3,(H,14,15) |
InChIKey | FBJIABNNCRFUEM-UHFFFAOYSA-N |
Molecular Weight | 241.718 g/mol |
SMILES | COC1=CC=C(NC(CCCCCl)=O)C=C1 |