CID 66289

10191-60-3

Structural Information

Molecular Formula

C₄H₆N₂S₂

SMILES

CSC(=NC#N)SC

InChI

InChI=1S/C4H6N2S2/c1-7-4(8-2)6-3-5/h1-2H3

InChIKey

IULFXBLVJIPESI-UHFFFAOYSA-N

Compound name

bis(methylsulfanyl)methylidenecyanamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 4
References: 1845
Patents: 145.99724 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	147.00452	122.1
[M+Na]+	168.98646	131.0
[M+NH4]+	164.03106	127.8
[M+K]+	184.96040	120.1
[M-H]-	144.98996	116.4
[M+Na-2H]-	166.97191	123.7
[M]+	145.99669	121.6
[M]-	145.99779	121.6

Literature stripe

literature stripe

Patent stripe

patents stripe