CID 64984934

1187932-87-1

Structural Information

Molecular Formula
C4H5ClN2S
SMILES
C1=C(SC(=N1)CN)Cl
InChI
InChI=1S/C4H5ClN2S/c5-3-2-7-4(1-6)8-3/h2H,1,6H2
InChIKey
NLZDROFQZLACEY-UHFFFAOYSA-N
Compound name
(5-chloro-1,3-thiazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

147.98619 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.99347 125.1
[M+Na]+ 170.97541 135.7
[M-H]- 146.97891 127.8
[M+NH4]+ 166.02001 148.1
[M+K]+ 186.94935 132.1
[M+H-H2O]+ 130.98345 120.3
[M+HCOO]- 192.98439 141.1
[M+CH3COO]- 207.00004 172.0
[M+Na-2H]- 168.96086 128.0
[M]+ 147.98564 126.9
[M]- 147.98674 126.9
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

No patent data available for this compound.