![alpha-[p-(Methylthio)anilino]-o-cresol](/api/spectrum/6PDCuEEmgeh/structure.png?h=300&w=458 "alpha-[p-(Methylthio)anilino]-o-cresol")
| SpectraBase Compound ID | BHx97LJkpGP |
|---|---|
| InChI | InChI=1S/C14H15NOS/c1-17-13-8-6-12(7-9-13)15-10-11-4-2-3-5-14(11)16/h2-9,15-16H,10H2,1H3 |
| InChIKey | NTQFKRXJKOBKKE-UHFFFAOYSA-N |
| Mol Weight | 245.34 g/mol |
| Molecular Formula | C14H15NOS |
| Exact Mass | 245.087435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6PDCuEEmgeh |
|---|---|
| Name | alpha-[p-(Methylthio)anilino]-o-cresol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.087435280 u |
| Formula | C14H15NOS |
| InChI | InChI=1S/C14H15NOS/c1-17-13-8-6-12(7-9-13)15-10-11-4-2-3-5-14(11)16/h2-9,15-16H,10H2,1H3 |
| InChIKey | NTQFKRXJKOBKKE-UHFFFAOYSA-N |
| Molecular Weight | 245.340 g/mol |
| SMILES | N(CC=1C(=CC=CC1)O)C=1C=CC(=CC1)SC |