CID 55285983

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

Structural Information

Molecular Formula
C4H5ClN2S
SMILES
CNC1=NC=C(S1)Cl
InChI
InChI=1S/C4H5ClN2S/c1-6-4-7-2-3(5)8-4/h2H,1H3,(H,6,7)
InChIKey
AURZOMYJKGRSBC-UHFFFAOYSA-N
Compound name
5-chloro-N-methyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

147.98619 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.993466 124.9
[M+Na]+ 170.975408 135.5
[M-H]- 146.978914 128.1
[M+NH4]+ 166.020013 148.1
[M+K]+ 186.949348 132.2
[M+H-H2O]+ 130.983450 120.0
[M+HCOO]- 192.984391 141.5
[M+CH3COO]- 207.000041 172.7
[M+Na-2H]- 168.960856 128.8
[M]+ 147.98564142 127.7
[M]- 147.98673858 127.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe