CID 6343

Ethanethiol

Structural Information

Molecular Formula

SMILES

CCS

InChI

InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3

InChIKey

DNJIEGIFACGWOD-UHFFFAOYSA-N

Compound name

ethanethiol

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 229
References: 24626
Patents: 62.01902 Da
Monoisotopic Mass: 0.9
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]+	63.026296	107.7
[M+Na]+	85.008238	119.5
[M+NH4]+	80.052843	118.1
[M+K]+	100.98218	111.5
[M-H]-	61.011744	108.9
[M+Na-2H]-	82.993686	112.9
[M]+	62.018471	110.2
[M]-	62.019569	110.2

Literature stripe

literature stripe

Patent stripe

patents stripe