trans-2,5-Dithiocyanatocyclopentanone
Compound with spectra: 2 NMR, and 1 MS (GC)
| SpectraBase Compound ID | 2zXoZeIWE6n |
|---|---|
| InChI | InChI=1S/C7H6N2OS2/c8-3-11-5-1-2-6(7(5)10)12-4-9/h5-6H,1-2H2/t5-,6-/m1/s1 |
| InChIKey | CQZMIAOSEYOVQA-PHDIDXHHSA-N |
| Mol Weight | 198.26 g/mol |
| Molecular Formula | C7H6N2OS2 |
| Exact Mass | 197.992155 g/mol |
| Enantiomer InChIKey | CQZMIAOSEYOVQA-WDSKDSINSA-N |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | J-57-2016-9 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
- CQZMIAOSEYOVQA-PHDIDXHHSA-N
- (1R,3R)-3-(cyanosulfanyl)-2-oxocyclopentyl thiocyanate
- [(1R,3R)-2-oxo-3-thiocyanato-cyclopentyl] thiocyanate
- [(1R,3R)-2-oxidanylidene-3-thiocyanato-cyclopentyl] thiocyanate
- thiocyanic acid[(1R,3R)-2-keto-3-thiocyanato-cyclopentyl]ester
- thiocyanic acid [(1R,3R)-2-oxo-3-thiocyanatocyclopentyl] ester
(2S*,6S*)-2-Methyl-6-(methylthio)cyclohexanone
(2S*,6R*)-2-Methyl-6-(methylthio)cyclohexanone
3-acetylthio-6-methyl-2-heptanone
Ethanethioic acid, S,S'-1,3-cyclopentanediyl ester, cis-
2,5-Thiophenedicarboxylic acid, tetrahydro-
3-acetylthio-2-heptanone
3-acetylthio-2-octanone
3-acetylthio-5-methyl-2-hexanone
(4S)-4-methyl-3-n-propylthio-2-hexanone
| Title | Journal or Book | Year |
|---|---|---|
| A general methodology for the synthesis of [2.2.1], [3.2.1+], and [4.2.1] bridged bicyclic disulfide systems | The Journal of Organic Chemistry | 1992 |
This compound is available in the following databases:
Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.