| SpectraBase Spectrum ID |
E0TB4JPjCfs |
| Name |
trans-2,5-Dithiocyanatocyclopentanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H6N2OS2 |
| 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 |
| Molecular Weight |
198.258 g/mol |
| SMILES |
C1([C@](SC#N)(CC[C@]1(SC#N)[H])[H])=O |
| SPLASH |
splash10-000f-0900000000-3501875e5492b14c0863 |
| Source of Spectrum |
J-57-2016-9 |
| Synonyms |
(1R,3R)-3-(cyanosulfanyl)-2-oxocyclopentyl thiocyanate
thiocyanic acid[(1R,3R)-2-keto-3-thiocyanato-cyclopentyl]ester
thiocyanic acid[(1R,3R)-2-oxo-3-thiocyanatocyclopentyl]ester
[(1R,3R)-2-oxidanylidene-3-thiocyanato-cyclopentyl]thiocyanate
[(1R,3R)-2-oxo-3-thiocyanato-cyclopentyl]thiocyanate
thiocyanic acid [(1R,3R)-2-oxo-3-thiocyanatocyclopentyl] ester
[(1R,3R)-2-oxo-3-thiocyanatocyclopentyl] thiocyanate
[(1R,3R)-2-oxo-3-thiocyanato-cyclopentyl] thiocyanate
[(1R,3R)-2-oxidanylidene-3-thiocyanato-cyclopentyl] thiocyanate |
| Wiley ID |
1194837 |
