CID 4173923

2245-12-7

Structural Information

Molecular Formula

C₄H₆N₂S₃

SMILES

CN1C(=S)SC(=S)N1C

InChI

InChI=1S/C4H6N2S3/c1-5-3(7)9-4(8)6(5)2/h1-2H3

InChIKey

JRAGPVKMVUMNAR-UHFFFAOYSA-N

Compound name

3,4-dimethyl-1,3,4-thiadiazolidine-2,5-dithione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 177.96931 Da
Monoisotopic Mass: 1.6
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]+	178.97659	136.9
[M+Na]+	200.95853	148.1
[M+NH4]+	196.00313	145.7
[M+K]+	216.93247	138.5
[M-H]-	176.96203	138.1
[M+Na-2H]-	198.94398	138.8
[M]+	177.96876	140.1
[M]-	177.96986	140.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe