| SpectraBase Compound ID | KtVdE49rWQj |
|---|---|
| InChI | InChI=1S/C18H26ClNO3/c1-3-4-5-6-7-10-13-23-17(21)14-20(2)18(22)15-11-8-9-12-16(15)19/h8-9,11-12H,3-7,10,13-14H2,1-2H3 |
| InChIKey | CEZWRROFJUFQGM-UHFFFAOYSA-N |
| Mol Weight | 339.86 g/mol |
| Molecular Formula | C18H26ClNO3 |
| Exact Mass | 339.160121 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 | 9e5pwQFr5gu |
|---|---|
| Name | Sarcosine, N-(2-chlorobenzoyl)-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.160121398 u |
| Formula | C18H26ClNO3 |
| InChI | InChI=1S/C18H26ClNO3/c1-3-4-5-6-7-10-13-23-17(21)14-20(2)18(22)15-11-8-9-12-16(15)19/h8-9,11-12H,3-7,10,13-14H2,1-2H3 |
| InChIKey | CEZWRROFJUFQGM-UHFFFAOYSA-N |
| Molecular Weight | 339.863 g/mol |
| SMILES | C1=CC=CC(=C1C(N(CC(OCCCCCCCC)=O)C)=O)Cl |