| SpectraBase Compound ID | 13NTHitEcIG |
|---|---|
| InChI | InChI=1S/C16H21NO2/c1-3-5-9-12-17(16(18)19-13-4-2)14-15-10-7-6-8-11-15/h2,6-8,10-11H,3,5,9,12-14H2,1H3 |
| InChIKey | ODOJXNRMLQHQFQ-UHFFFAOYSA-N |
| Mol Weight | 259.35 g/mol |
| Molecular Formula | C16H21NO2 |
| Exact Mass | 259.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Csg3ouAnBGF |
|---|---|
| Name | Carbonic acid, monoamide, N-benzyl-N-pentyl-, propargyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.157228918 u |
| Formula | C16H21NO2 |
| InChI | InChI=1S/C16H21NO2/c1-3-5-9-12-17(16(18)19-13-4-2)14-15-10-7-6-8-11-15/h2,6-8,10-11H,3,5,9,12-14H2,1H3 |
| InChIKey | ODOJXNRMLQHQFQ-UHFFFAOYSA-N |
| Molecular Weight | 259.349 g/mol |
| SMILES | C(N(CCCCC)CC1=CC=CC=C1)(=O)OCC#C |