| SpectraBase Compound ID | 3OLesmJERRm |
|---|---|
| InChI | InChI=1S/C12H17NO2/c1-3-4-9-13-12(14)10-5-7-11(15-2)8-6-10/h5-8H,3-4,9H2,1-2H3,(H,13,14) |
| InChIKey | PCJWVQUPHYPGIE-UHFFFAOYSA-N |
| Mol Weight | 207.27 g/mol |
| Molecular Formula | C12H17NO2 |
| Exact Mass | 207.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Rl5s9wnnFC |
|---|---|
| Name | Benzamide, 4-methoxy-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.125928789 u |
| Formula | C12H17NO2 |
| InChI | InChI=1S/C12H17NO2/c1-3-4-9-13-12(14)10-5-7-11(15-2)8-6-10/h5-8H,3-4,9H2,1-2H3,(H,13,14) |
| InChIKey | PCJWVQUPHYPGIE-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | C1=C(C=CC(=C1)OC)C(NCCCC)=O |