CID 520409

1,2,4,5-tetrathiane

Structural Information

Molecular Formula

C₂H₄S₄

SMILES

C1SSCSS1

InChI

InChI=1S/C2H4S4/c1-3-5-2-6-4-1/h1-2H2

InChIKey

VXTWQLLUXWBOGW-UHFFFAOYSA-N

Compound name

1,2,4,5-tetrathiane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 3
References: 74
Patents: 155.91959 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]+	156.92687	117.0
[M+Na]+	178.90881	125.8
[M+NH4]+	173.95341	128.1
[M+K]+	194.88275	114.3
[M-H]-	154.91231	120.6
[M+Na-2H]-	176.89426	120.5
[M]+	155.91904	121.0
[M]-	155.92014	121.0

Literature stripe

literature stripe

Patent stripe

patents stripe