CID 419402

23224-08-0

Structural Information

Molecular Formula

C₁₁H₁₀N₂OS

SMILES

C1CN2C(=CSC2=N1)C3=CC=C(C=C3)O

InChI

InChI=1S/C11H10N2OS/c14-9-3-1-8(2-4-9)10-7-15-11-12-5-6-13(10)11/h1-4,7,14H,5-6H2

InChIKey

VHAXYBWGPIXDEA-UHFFFAOYSA-N

Compound name

4-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 218.05139 Da
Monoisotopic Mass: 1.4
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]+	219.058666	145.5
[M+Na]+	241.040608	156.2
[M-H]-	217.044114	150.5
[M+NH4]+	236.085213	166.4
[M+K]+	257.014548	152.2
[M+H-H2O]+	201.048650	139.6
[M+HCOO]-	263.049591	162.5
[M+CH3COO]-	277.065241	158.9
[M+Na-2H]-	239.026056	146.9
[M]+	218.05084142	147.0
[M]-	218.05193858	147.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe