| SpectraBase Compound ID | IgyBP1yV3XX |
|---|---|
| InChI | InChI=1S/C19H31NO3S/c1-3-4-5-6-7-8-9-10-11-14-23-18(21)16-20(2)19(22)17-13-12-15-24-17/h12-13,15H,3-11,14,16H2,1-2H3 |
| InChIKey | CNWALIJDAOCYFT-UHFFFAOYSA-N |
| Mol Weight | 353.52 g/mol |
| Molecular Formula | C19H31NO3S |
| Exact Mass | 353.202465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6qYuDdjFMeM |
|---|---|
| Name | Sarcosine, N-(2-thienylcarbonyl)-, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.202465033 u |
| Formula | C19H31NO3S |
| InChI | InChI=1S/C19H31NO3S/c1-3-4-5-6-7-8-9-10-11-14-23-18(21)16-20(2)19(22)17-13-12-15-24-17/h12-13,15H,3-11,14,16H2,1-2H3 |
| InChIKey | CNWALIJDAOCYFT-UHFFFAOYSA-N |
| Molecular Weight | 353.521 g/mol |
| SMILES | C(CCCCCOC(CN(C(=O)C1=CC=CS1)C)=O)CCCCC |