| SpectraBase Compound ID | 1LvO1Rctn6u |
|---|---|
| InChI | InChI=1S/C14H11ClO2S/c1-17-14(16)12-7-2-3-8-13(12)18-11-6-4-5-10(15)9-11/h2-9H,1H3 |
| InChIKey | RPQRIQUBVPZYKN-UHFFFAOYSA-N |
| Mol Weight | 278.75 g/mol |
| Molecular Formula | C14H11ClO2S |
| Exact Mass | 278.016828 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5nmM9bLZaPe |
|---|---|
| Name | Methyl 2-(3-chlorophenylsulfanyl)-benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H11ClO2S |
| InChI | InChI=1S/C14H11ClO2S/c1-17-14(16)12-7-2-3-8-13(12)18-11-6-4-5-10(15)9-11/h2-9H,1H3 |
| InChIKey | RPQRIQUBVPZYKN-UHFFFAOYSA-N |
| Molecular Weight | 278.753 g/mol |
| SMILES | c1(c(Sc2cc(Cl)ccc2)cccc1)C(=O)OC |
| SPLASH | splash10-004i-0290000000-b98fdd0fa72f6b915439 |
| Source of Spectrum | F-65-8798-5d |
| Wiley ID | 1679253 |