Benzylmercaptan
Compound with open access spectra: 10 NMR, 9 FTIR, 2 Near IR, and 10 MS
| SpectraBase Compound ID | 5ZgH7p1M5K3 |
|---|---|
| InChI | InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2 |
| InChIKey | UENWRTRMUIOCKN-UHFFFAOYSA-N |
| Mol Weight | 124.2 g/mol |
| Molecular Formula | C7H8S |
| Exact Mass | 124.034672 g/mol |
| Copyright | Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | The Matheson Company, Inc., East Rutherford, New Jersey |
| Technique | CAPILLARY CELL: NEAT |
| Copyright | Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | The Matheson Company, Inc., East Rutherford, New Jersey |
| Technique | CAPILLARY CELL: NEAT |
| Copyright | Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | W214701 |
| Technique | Between salts |
| Copyright | Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | W214701 |
| Copyright | Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | B25401 |
| Technique | Neat |
| Copyright | Copyright © 1989, 1990-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Source of Spectrum | Prof. Buback, University of Goettingen, Germany |
| Copyright | Copyright © 1989, 1990-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Source of Spectrum | Prof. Buback, University of Goettingen, Germany |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AD-0-619-0 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | LQ-1992-2205-0 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | EP-3784-0-0 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JC-483-29-11 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | TA-0-2064-0 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JZ-1992-841-0 |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SO-0-374-0 |
| Copyright | Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | MCB Manufacturing Chemists, Norwood, Ohio |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3 |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO |
| Copyright | Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | B25401 |
| Solvent | CDCl3 |
| Copyright | Copyright © 2009-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | The Matheson Company, Inc., East Rutherford, New Jersey |
| Solvent | CCl4 |
| Copyright | Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | B25401 |
| Solvent | CDCl3 |
| Copyright | Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | B25401 |
| Copyright | Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | B25401 |
| Copyright | Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | W214701 |
- alpha-Toluenethiol
- Benzenemethanethiol
- THIOBENZYL ALCOHOL
- PHENYLMETHANTHIOL
- alpha-MERCAPTOTOLUENE
- PHENYLMETHANETHIOL
- BENZYLTHIOL
- BENZYL HYDROSULFIDE
- alpha-Tolyl mercaptan
Molybdenum, tetrakis(benzenemethanethiolato)di-2,4-cyclopentadien-1-yldinitrosyldi-
Benzyl methyl sulfide
Deuterio-A-toluenethiol
S-(benzyl)thiohydroxylamine
alpha-IODOTOLUENE
Benzyl-lithium
PDL 2-400, POLYMETHYLSTYRENE, POLYVINYLTOLUENE (SAMPLE FROM 1955)
Phenyl-methyl-carbenium cation
DIETHYLBENZENE*MIXTURE OF o-, m-, p-ISOMERS
Benzylammonium cation
| Title | Journal or Book | Year |
|---|---|---|
| 13C NMR chemical shifts of thiols, sulfinic acids, sulfinyl chlorides, sulfonic acids and sulfonic anhydrides | Organic Magnetic Resonance | 1983 |
| A carbon-13 nuclear magnetic resonance study of thiol esters | The Journal of Organic Chemistry | 1977 |