CID 675262

74605-12-2

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂S

SMILES

COC1=CC(=C(C=C1)OC)C2=CSC(=N2)N

InChI

InChI=1S/C11H12N2O2S/c1-14-7-3-4-10(15-2)8(5-7)9-6-16-11(12)13-9/h3-6H,1-2H3,(H2,12,13)

InChIKey

FXGVKHSZIMCUTR-UHFFFAOYSA-N

Compound name

4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 21
Patents: 236.06195 Da
Monoisotopic Mass: 2.2
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]+	237.069226	149.6
[M+Na]+	259.051168	159.7
[M-H]-	235.054674	155.8
[M+NH4]+	254.095773	168.4
[M+K]+	275.025108	156.2
[M+H-H2O]+	219.059210	142.7
[M+HCOO]-	281.060151	170.2
[M+CH3COO]-	295.075801	191.0
[M+Na-2H]-	257.036616	151.1
[M]+	236.06140142	153.6
[M]-	236.06249858	153.6

Literature stripe

literature stripe

Patent stripe

patents stripe