![[4-(Acetaminomethyl)phenyl]methanamine](/api/spectrum/21UKTTLY7L/structure.png?h=300&w=458 "[4-(Acetaminomethyl)phenyl]methanamine")
| SpectraBase Compound ID | EnIrkJOz9QR |
|---|---|
| InChI | InChI=1S/C10H14N2O/c1-8(13)12-7-10-4-2-9(6-11)3-5-10/h2-5H,6-7,11H2,1H3,(H,12,13) |
| InChIKey | LMWLRQKZZZGYDQ-UHFFFAOYSA-N |
| Mol Weight | 178.23 g/mol |
| Molecular Formula | C10H14N2O |
| Exact Mass | 178.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 21UKTTLY7L |
|---|---|
| Name | [4-(Acetaminomethyl)phenyl]methanamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.110613078 u |
| Formula | C10H14N2O |
| InChI | InChI=1S/C10H14N2O/c1-8(13)12-7-10-4-2-9(6-11)3-5-10/h2-5H,6-7,11H2,1H3,(H,12,13) |
| InChIKey | LMWLRQKZZZGYDQ-UHFFFAOYSA-N |
| Molecular Weight | 178.235 g/mol |
| SMILES | C1=CC(=CC=C1CN)CNC(C)=O |