| SpectraBase Compound ID | CEBjYNaHomL |
|---|---|
| InChI | InChI=1S/C21H33NO3/c1-4-5-6-7-8-9-10-11-15-25-20(23)17-22(3)21(24)19-14-12-13-18(2)16-19/h12-14,16H,4-11,15,17H2,1-3H3 |
| InChIKey | AUDAXUIXZUCITC-UHFFFAOYSA-N |
| Mol Weight | 347.5 g/mol |
| Molecular Formula | C21H33NO3 |
| Exact Mass | 347.246044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DhhnkC4tZ2v |
|---|---|
| Name | Sarcosine, N-(3-methylbenzoyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.246043924 u |
| Formula | C21H33NO3 |
| InChI | InChI=1S/C21H33NO3/c1-4-5-6-7-8-9-10-11-15-25-20(23)17-22(3)21(24)19-14-12-13-18(2)16-19/h12-14,16H,4-11,15,17H2,1-3H3 |
| InChIKey | AUDAXUIXZUCITC-UHFFFAOYSA-N |
| Molecular Weight | 347.499 g/mol |
| SMILES | C1=CC(=CC(=C1)C)C(N(CC(OCCCCCCCCCC)=O)C)=O |