SpectraBase Compound ID | AkDENQJqcFC |
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InChI | InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 |
InChIKey | HNKJADCVZUBCPG-UHFFFAOYSA-N |
Mol Weight | 124.2 g/mol |
Molecular Formula | C7H8S |
Exact Mass | 124.034671 g/mol |
SpectraBase Spectrum ID | 4TZle2TB53j |
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Name | Thioanisole |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | T28002 |
CAS Registry Number | 100-68-5 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H8S |
InChI | InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 |
InChIKey | HNKJADCVZUBCPG-UHFFFAOYSA-N |
Observed nucleus | 1H |
Purity | 99% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Synonyms | Methyl phenyl sulfide |
Wiley ID | SIAL_1HNMR_012709 |