CID 329965

75224-64-5

Structural Information

Molecular Formula

C₁₂H₁₀N₂OS

SMILES

C1CSC2=NC(=C(N21)C=O)C3=CC=CC=C3

InChI

InChI=1S/C12H10N2OS/c15-8-10-11(9-4-2-1-3-5-9)13-12-14(10)6-7-16-12/h1-5,8H,6-7H2

InChIKey

XOGXXJXDZCAAPL-UHFFFAOYSA-N

Compound name

6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 32
Patents: 230.05139 Da
Monoisotopic Mass: 2.0
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]+	231.05867	149.7
[M+Na]+	253.04061	160.7
[M-H]-	229.04411	155.9
[M+NH4]+	248.08521	170.7
[M+K]+	269.01455	156.7
[M+H-H2O]+	213.04865	143.3
[M+HCOO]-	275.04959	168.0
[M+CH3COO]-	289.06524	163.3
[M+Na-2H]-	251.02606	150.8
[M]+	230.05084	152.6
[M]-	230.05194	152.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe