S-Methylisopentanthioate
Compound with spectra: 4 NMR, 1 FTIR, and 1 MS (GC)
| SpectraBase Compound ID | 4wPOvaPI4IN |
|---|---|
| InChI | InChI=1S/C6H12OS/c1-5(2)4-6(7)8-3/h5H,4H2,1-3H3 |
| InChIKey | MPLWTJZAFOVXKP-UHFFFAOYSA-N |
| Mol Weight | 132.22 g/mol |
| Molecular Formula | C6H12OS |
| Exact Mass | 132.060886 g/mol |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | G. Dauphin, A. Cuer Org. Magn. Resonance 12, 557(1979) |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Jeol FX-60 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCL3 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | W5-1989-33897-31639 |
- 3-METHYLTHIOBUTYRIC ACID, S-METHYL ESTER
- ISOVALERIC ACID, THIO-, S-METHYL ESTER
- BUTYRIC ACID, 3-METHYLTHIO-, S-METHYL ESTER
- S-Methyl 3-methylbutanethioate
- Methyl 3-methyl-thiol-butyrate
- BUTANETHIOC ACID, 3-METHYL-S-METHYL ESTER
- 3-Methylbutanethioic acid S-methyl ester
- Butanethioic acid, 3-methyl-, S-methyl ester
- Methanethiol isovalerate
- EINECS 245-863-6
S-Methylbutanthioate
S-Methylpropanthioate
S-Methyl 4-methylpentanethioate
S-Methyl 3,3-dimethylbutanethioate
Dihydro-4-methyl-2(3H)-thiophenone
S-Methyl pentanethioate
S-Methyl 2-methylpropanethioate
2-cyanoethanethioic acid S-methyl ester
S-METHYL-2-METHYLBUTANTHIOATE
MBTA;S-METHYL-BROMOTHIOACETATE
| Title | Journal or Book | Year |
|---|---|---|
| RMN du13C de Composés Méthylés Soufrés | Organic Magnetic Resonance | 1979 |
This compound is available in the following databases:
Wiley SmartSpectra IR Database
Author: Wiley
Designed for use with Wiley’s KnowItAll IR Spectral Library collection, this computed IR database can be used in unknown identification to expand your available chemical compound coverage and improve your analytical workflow. Learn more.
Wiley SmartSpectra Vapor Phase IR Database Collection
Author: Wiley
Designed for use with Wiley’s KnowItAll IR Spectral Library collection, this computed VPIR database can be used in unknown identification to expand your available chemical compound coverage and improve your analytical workflow. Learn more.
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.