CID 365869

34467-14-6

Structural Information

Molecular Formula

C₉H₁₂N₂O₂S

SMILES

CCOC(=O)CC1=CSC2=NCCN12

InChI

InChI=1S/C9H12N2O2S/c1-2-13-8(12)5-7-6-14-9-10-3-4-11(7)9/h6H,2-5H2,1H3

InChIKey

IWXSEVRNVJJFOY-UHFFFAOYSA-N

Compound name

ethyl 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 0
Patents: 212.06195 Da
Monoisotopic Mass: 0.3
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]+	213.069226	146.9
[M+Na]+	235.051168	156.1
[M-H]-	211.054674	149.4
[M+NH4]+	230.095773	168.5
[M+K]+	251.025108	154.8
[M+H-H2O]+	195.059210	141.1
[M+HCOO]-	257.060151	163.6
[M+CH3COO]-	271.075801	183.1
[M+Na-2H]-	233.036616	147.0
[M]+	212.06140142	151.3
[M]-	212.06249858	151.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.