SpectraBase Compound ID | 7mJ6HTSVFmJ |
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InChI | InChI=1S/C9H11ClN2O/c10-8-3-1-7(2-4-8)9(13)12-6-5-11/h1-4H,5-6,11H2,(H,12,13) |
InChIKey | AIHKMGLJGLKLSI-UHFFFAOYSA-N |
Mol Weight | 198.65 g/mol |
Molecular Formula | C9H11ClN2O |
Exact Mass | 198.055991 g/mol |
SpectraBase Spectrum ID | AoV2Hcxzt3C |
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Name | N-(2-Aminoethyl)-4-chlorobenzamide |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 198.055990681 u |
Formula | C9H11ClN2O |
InChI | InChI=1S/C9H11ClN2O/c10-8-3-1-7(2-4-8)9(13)12-6-5-11/h1-4H,5-6,11H2,(H,12,13) |
InChIKey | AIHKMGLJGLKLSI-UHFFFAOYSA-N |
Molecular Weight | 198.653 g/mol |
SMILES | C1(Cl)=CC=C(C=C1)C(=O)NCCN |