| SpectraBase Compound ID | 78iVKqcFZ7Z |
|---|---|
| InChI | InChI=1S/C17H27NO3S/c1-3-4-5-6-7-8-11-21-17(20)14-18(2)16(19)13-15-10-9-12-22-15/h9-10,12H,3-8,11,13-14H2,1-2H3 |
| InChIKey | JSNNJCXEPQZDDG-UHFFFAOYSA-N |
| Mol Weight | 325.47 g/mol |
| Molecular Formula | C17H27NO3S |
| Exact Mass | 325.171165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bjzm84bi37d |
|---|---|
| Name | Sarcosine, N-(2-thiophenylacetyl)-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.171164904 u |
| Formula | C17H27NO3S |
| InChI | InChI=1S/C17H27NO3S/c1-3-4-5-6-7-8-11-21-17(20)14-18(2)16(19)13-15-10-9-12-22-15/h9-10,12H,3-8,11,13-14H2,1-2H3 |
| InChIKey | JSNNJCXEPQZDDG-UHFFFAOYSA-N |
| Molecular Weight | 325.467 g/mol |
| SMILES | CN(C(CC1=CC=CS1)=O)CC(OCCCCCCCC)=O |