| SpectraBase Compound ID | 7PgyIqm2fH |
|---|---|
| InChI | InChI=1S/C14H20N2O/c1-12-4-3-5-14(10-12)11-15-6-8-16(9-7-15)13(2)17/h3-5,10H,6-9,11H2,1-2H3 |
| InChIKey | CMCBVCKQOHOWJO-UHFFFAOYSA-N |
| Mol Weight | 232.33 g/mol |
| Molecular Formula | C14H20N2O |
| Exact Mass | 232.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ku70VxOaj |
|---|---|
| Name | Meclozine-m/artifact ac P518 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.157563271 u |
| Formula | C14H20N2O |
| InChI | InChI=1S/C14H20N2O/c1-12-4-3-5-14(10-12)11-15-6-8-16(9-7-15)13(2)17/h3-5,10H,6-9,11H2,1-2H3 |
| InChIKey | CMCBVCKQOHOWJO-UHFFFAOYSA-N |
| Molecular Weight | 232.327 g/mol |
| SMILES | CC=1C=C(CN2CCN(C(=O)C)CC2)C=CC1 |