| SpectraBase Spectrum ID |
6epiKN2YUJp |
| Name |
Thiocyanic acid, 1,2-diethyl-1,2-ethenediyl ester, (E)- |
| Alternate Name(s) |
(1E)-2-(cyanosulfanyl)-1-ethyl-1-butenyl thiocyanate
(E)-3,4-Dithiocyanatohex-3-ene |
| CAS Registry Number |
76014-48-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H10N2S2 |
| InChI |
InChI=1S/C8H10N2S2/c1-3-7(11-5-9)8(4-2)12-6-10/h3-4H2,1-2H3/b8-7+ |
| InChIKey |
PJRRAGOZEXTGOH-BQYQJAHWSA-N |
| Molecular Weight |
198.302 g/mol |
| SMILES |
C(#N)S\C(=C/(SC#N)CC)CC |
| SPLASH |
splash10-00di-9200000000-22435a2bc00adaea13fb |
| Source of Spectrum |
KC-1987-1019-3 |
| Wiley ID |
1194953 |
