CID 159644

2104-04-3

Structural Information

Molecular Formula

C₁₀H₁₀N₂OS

SMILES

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

InChI

InChI=1S/C10H10N2OS/c1-13-8-4-2-7(3-5-8)9-6-14-10(11)12-9/h2-6H,1H3,(H2,11,12)

InChIKey

YPVVEXKDPBRGIK-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 11
References: 255
Patents: 206.05139 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]+	207.05867	142.5
[M+Na]+	229.04061	155.2
[M+NH4]+	224.08521	151.8
[M+K]+	245.01455	148.4
[M-H]-	205.04411	146.9
[M+Na-2H]-	227.02606	150.4
[M]+	206.05084	146.0
[M]-	206.05194	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe