![Benzoic acid, 2-[(2-phenylethyl)thio]-, methyl ester](/api/spectrum/9zlzfBXvVFW/structure.png?h=300&w=458 "Benzoic acid, 2-[(2-phenylethyl)thio]-, methyl ester")
| SpectraBase Compound ID | I50HD3edCN9 |
|---|---|
| InChI | InChI=1S/C16H16O2S/c1-18-16(17)14-9-5-6-10-15(14)19-12-11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3 |
| InChIKey | UCWGVBOFJQNVME-UHFFFAOYSA-N |
| Mol Weight | 272.36 g/mol |
| Molecular Formula | C16H16O2S |
| Exact Mass | 272.087101 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 9zlzfBXvVFW |
|---|---|
| Name | Benzoic acid, 2-[(2-phenylethyl)thio]-, methyl ester |
| CAS Registry Number | 2178-18-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H16O2S |
| InChI | InChI=1S/C16H16O2S/c1-18-16(17)14-9-5-6-10-15(14)19-12-11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3 |
| InChIKey | UCWGVBOFJQNVME-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Synonyms | Benzoic acid, o-(phenethylthio)-, methyl ester |
| Technique | Film |