CID 853574

57332-73-7

Structural Information

Molecular Formula

C₉H₁₀N₂O₂S

SMILES

CCOC(=O)CC1=CN2C=CSC2=N1

InChI

InChI=1S/C9H10N2O2S/c1-2-13-8(12)5-7-6-11-3-4-14-9(11)10-7/h3-4,6H,2,5H2,1H3

InChIKey

DSVFDEWSKWCGEY-UHFFFAOYSA-N

Compound name

ethyl 2-imidazo[2,1-b][1,3]thiazol-6-ylacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 210.0463 Da
Monoisotopic Mass: 2.1
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]+	211.05358	144.8
[M+Na]+	233.03552	155.7
[M+NH4]+	228.08012	152.9
[M+K]+	249.00946	151.8
[M-H]-	209.03902	144.9
[M+Na-2H]-	231.02097	148.6
[M]+	210.04575	146.6
[M]-	210.04685	146.6

Literature stripe

literature stripe

Patent stripe

patents stripe