| SpectraBase Compound ID | J5R1fDLY7cO |
|---|---|
| InChI | InChI=1S/C16H17NOS/c1-13-7-9-15(10-8-13)19-12-16(18)17-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,17,18) |
| InChIKey | ZCVGBMHUNZITFH-UHFFFAOYSA-N |
| Mol Weight | 271.38 g/mol |
| Molecular Formula | C16H17NOS |
| Exact Mass | 271.103085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ekw7fwC7rvv |
|---|---|
| Name | 2-(4-Methylphenyl)sulfanyl-N-(phenylmethyl)ethanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.103085344 u |
| Formula | C16H17NOS |
| InChI | InChI=1S/C16H17NOS/c1-13-7-9-15(10-8-13)19-12-16(18)17-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,17,18) |
| InChIKey | ZCVGBMHUNZITFH-UHFFFAOYSA-N |
| SMILES | C(NCC1=CC=CC=C1)(=O)CSC=1C=CC(=CC1)C |