| SpectraBase Compound ID | 398YBlywAIl |
|---|---|
| InChI | InChI=1S/C18H18ClNO2/c1-12(22-17-8-3-2-7-16(17)19)18(21)20-15-10-9-13-5-4-6-14(13)11-15/h2-3,7-12H,4-6H2,1H3,(H,20,21) |
| InChIKey | GHTBUJNELROUMJ-UHFFFAOYSA-N |
| Mol Weight | 315.8 g/mol |
| Molecular Formula | C18H18ClNO2 |
| Exact Mass | 315.102607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KddZHERCIZU |
|---|---|
| Name | 2-(2-Chlorophenoxy)-N-(2,3-dihydro-1H-inden-5-yl)propanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.102606522 u |
| Formula | C18H18ClNO2 |
| InChI | InChI=1S/C18H18ClNO2/c1-12(22-17-8-3-2-7-16(17)19)18(21)20-15-10-9-13-5-4-6-14(13)11-15/h2-3,7-12H,4-6H2,1H3,(H,20,21) |
| InChIKey | GHTBUJNELROUMJ-UHFFFAOYSA-N |
| SMILES | N(C=1C=C2C(=CC1)CCC2)C(C(OC=1C(Cl)=CC=CC1)C)=O |