CID 83157418

4-chloro-n-ethyl-1,3-thiazol-2-amine

Structural Information

Molecular Formula

C₅H₇ClN₂S

SMILES

CCNC1=NC(=CS1)Cl

InChI

InChI=1S/C5H7ClN2S/c1-2-7-5-8-4(6)3-9-5/h3H,2H2,1H3,(H,7,8)

InChIKey

WMLSIINMMPJHTC-UHFFFAOYSA-N

Compound name

4-chloro-N-ethyl-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 162.00185 Da
Monoisotopic Mass: 2.6
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]+	163.00913	130.2
[M+Na]+	184.99107	141.9
[M+NH4]+	180.03567	139.9
[M+K]+	200.96501	134.9
[M-H]-	160.99457	132.4
[M+Na-2H]-	182.97652	136.0
[M]+	162.00130	133.1
[M]-	162.00240	133.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.