![1-[4-[(4-Aminophenyl)thio]phenyl]ethanone](/api/spectrum/4YWBUcvQaDq/structure.png?h=300&w=458 "1-[4-[(4-Aminophenyl)thio]phenyl]ethanone")
| SpectraBase Compound ID | BSG2atgh6K |
|---|---|
| InChI | InChI=1S/C14H13NOS/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-9H,15H2,1H3 |
| InChIKey | HUQJWQVETOTHCM-UHFFFAOYSA-N |
| Mol Weight | 243.32 g/mol |
| Molecular Formula | C14H13NOS |
| Exact Mass | 243.071785 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4YWBUcvQaDq |
|---|---|
| Name | 1-[4-[(4-Aminophenyl)thio]phenyl]ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.071785216 u |
| Formula | C14H13NOS |
| InChI | InChI=1S/C14H13NOS/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-9H,15H2,1H3 |
| InChIKey | HUQJWQVETOTHCM-UHFFFAOYSA-N |
| Molecular Weight | 243.324 g/mol |
| SMILES | C=1(SC=2C=CC(=CC2)N)C=CC(=CC1)C(=O)C |