CID 3799990

4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C10H9FN2OS
SMILES
COC1=C(C=C(C=C1)F)C2=CSC(=N2)N
InChI
InChI=1S/C10H9FN2OS/c1-14-9-3-2-6(11)4-7(9)8-5-15-10(12)13-8/h2-5H,1H3,(H2,12,13)
InChIKey
AJSHECLHRCNMOP-UHFFFAOYSA-N
Compound name
4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.04196 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.04924 143.8
[M+Na]+ 247.03118 154.6
[M-H]- 223.03468 148.8
[M+NH4]+ 242.07578 163.2
[M+K]+ 263.00512 150.3
[M+H-H2O]+ 207.03922 136.2
[M+HCOO]- 269.04016 163.5
[M+CH3COO]- 283.05581 188.6
[M+Na-2H]- 245.01663 145.1
[M]+ 224.04141 145.1
[M]- 224.04251 145.1
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.