![4-[(4-Azanylcyclohexyl)methyl]aniline](/api/spectrum/IVBBPWBfFbo/structure.png?h=300&w=458 "4-[(4-Azanylcyclohexyl)methyl]aniline")
| SpectraBase Compound ID | AI2VDYPwW9R |
|---|---|
| InChI | InChI=1S/C13H20N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-2,5-6,11,13H,3-4,7-9,14-15H2 |
| InChIKey | NRVOGWCXEOJNFS-UHFFFAOYSA-N |
| Mol Weight | 204.32 g/mol |
| Molecular Formula | C13H20N2 |
| Exact Mass | 204.162649 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVBBPWBfFbo |
|---|---|
| Name | 4-[(4-Azanylcyclohexyl)methyl]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.162648652 u |
| Formula | C13H20N2 |
| InChI | InChI=1S/C13H20N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-2,5-6,11,13H,3-4,7-9,14-15H2 |
| InChIKey | NRVOGWCXEOJNFS-UHFFFAOYSA-N |
| Molecular Weight | 204.317 g/mol |
| SMILES | C=1(N)C=CC(=CC1)CC1CCC(N)CC1 |