CID 38942

41663-73-4

Structural Information

Molecular Formula

C₃H₃ClN₂S

SMILES

C1=C(SC(=N1)N)Cl

InChI

InChI=1S/C3H3ClN2S/c4-2-1-6-3(5)7-2/h1H,(H2,5,6)

InChIKey

SWQWTDAWUSBMGA-UHFFFAOYSA-N

Compound name

5-chloro-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 1017
Patents: 133.97055 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]+	134.97783	120.6
[M+Na]+	156.95977	131.7
[M-H]-	132.96327	123.5
[M+NH4]+	152.00437	144.2
[M+K]+	172.93371	128.3
[M+H-H2O]+	116.96781	116.0
[M+HCOO]-	178.96875	136.9
[M+CH3COO]-	192.98440	168.9
[M+Na-2H]-	154.94522	124.0
[M]+	133.97000	122.0
[M]-	133.97110	122.0

Literature stripe

literature stripe

Patent stripe

patents stripe