| SpectraBase Compound ID | 6CR1yd23zdU |
|---|---|
| InChI | InChI=1S/C16H24ClNO/c1-3-4-5-6-7-11-18(16(19)13-17)15-10-8-9-14(2)12-15/h8-10,12H,3-7,11,13H2,1-2H3 |
| InChIKey | CXTUMFRDQUSBHQ-UHFFFAOYSA-N |
| Mol Weight | 281.83 g/mol |
| Molecular Formula | C16H24ClNO |
| Exact Mass | 281.154642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KhRqEhy8WZ3 |
|---|---|
| Name | 2-Chloro-N-heptyl-N-(m-tolyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.154642096 u |
| Formula | C16H24ClNO |
| InChI | InChI=1S/C16H24ClNO/c1-3-4-5-6-7-11-18(16(19)13-17)15-10-8-9-14(2)12-15/h8-10,12H,3-7,11,13H2,1-2H3 |
| InChIKey | CXTUMFRDQUSBHQ-UHFFFAOYSA-N |
| SMILES | C(CCl)(=O)N(C1=CC(=CC=C1)C)CCCCCCC |