CID 2756433

3830-48-6

Structural Information

Molecular Formula

C₁₀H₉FN₂S

SMILES

CC1=C(C=CC(=C1)C2=CSC(=N2)N)F

InChI

InChI=1S/C10H9FN2S/c1-6-4-7(2-3-8(6)11)9-5-14-10(12)13-9/h2-5H,1H3,(H2,12,13)

InChIKey

XJPFIMKKTVFXIN-UHFFFAOYSA-N

Compound name

4-(4-fluoro-3-methylphenyl)-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 208.04704 Da
Monoisotopic Mass: 2.7
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]+	209.05432	142.5
[M+Na]+	231.03626	154.9
[M+NH4]+	226.08086	151.4
[M+K]+	247.01020	147.9
[M-H]-	207.03976	145.7
[M+Na-2H]-	229.02171	149.7
[M]+	208.04649	145.6
[M]-	208.04759	145.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe