CID 613228

105512-88-7

Structural Information

Molecular Formula

C₁₁H₁₂N₂OS

SMILES

CC1=C(N=C(S1)N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C11H12N2OS/c1-7-10(13-11(12)15-7)8-3-5-9(14-2)6-4-8/h3-6H,1-2H3,(H2,12,13)

InChIKey

WUTXFLYFZOMYSF-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 72
Patents: 220.06703 Da
Monoisotopic Mass: 2.6
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]+	221.07431	147.3
[M+Na]+	243.05625	160.1
[M+NH4]+	238.10085	156.4
[M+K]+	259.03019	153.3
[M-H]-	219.05975	151.7
[M+Na-2H]-	241.04170	154.6
[M]+	220.06648	150.8
[M]-	220.06758	150.8

Literature stripe

literature stripe

Patent stripe

patents stripe