CID 703479

5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-amine hydrochloride

Structural Information

Molecular Formula
C10H9FN2S
SMILES
C1=CC(=CC=C1CC2=CN=C(S2)N)F
InChI
InChI=1S/C10H9FN2S/c11-8-3-1-7(2-4-8)5-9-6-13-10(12)14-9/h1-4,6H,5H2,(H2,12,13)
InChIKey
KIZWUMGELVDUQL-UHFFFAOYSA-N
Compound name
5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

59
Patents

208.04704 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.05432 141.9
[M+Na]+ 231.03626 154.0
[M+NH4]+ 226.08086 150.8
[M+K]+ 247.01020 146.8
[M-H]- 207.03976 145.1
[M+Na-2H]- 229.02171 149.4
[M]+ 208.04649 144.9
[M]- 208.04759 144.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe