4-Methoxythiophenol
1461
Reference
4-Methoxythiophenol Structure
Systematic / IUPAC Name: 4-Methoxybenzenethiol
ID: Reference1461
Other Names:
p-Methoxybenzenethiol;
Benzenethiol, 4-methoxy-;
Benzenethiol, p-methoxy-;
4-Mercaptoanisole
Formula: C7H8OS
Spectral Data
4-Methoxythiophenol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 71 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 12/3/2014 12:19:53 PM |
Identificators
| InChI | InChI=1S/C7H8OS/c1-8-6-2-4-7(9)5-3-6/h2-5,9H,1H3 |
| InChI Key | NIFAOMSJMGEFTQ-UHFFFAOYSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)S |
| CAS | 696639 |
| Splash | |
| Other Names |
p-Methoxybenzenethiol; Benzenethiol, 4-methoxy-; Benzenethiol, p-methoxy-; 4-Mercaptoanisole |
In Other Databases
| PubChem | 12765 |
| ChemIDPlus | 000696639 |
| ChemSpider | 12240 |
| ChEMBL | CHEMBL119636 |