CID 54594861

1-{6-chloroimidazo[2,1-b][1,3]thiazol-5-yl}ethan-1-ol

Structural Information

Molecular Formula
C7H7ClN2OS
SMILES
CC(C1=C(N=C2N1C=CS2)Cl)O
InChI
InChI=1S/C7H7ClN2OS/c1-4(11)5-6(8)9-7-10(5)2-3-12-7/h2-4,11H,1H3
InChIKey
PNSGXXCGFMEHNT-UHFFFAOYSA-N
Compound name
1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.99677 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.00405 139.2
[M+Na]+ 224.98599 152.3
[M-H]- 200.98949 141.7
[M+NH4]+ 220.03059 161.9
[M+K]+ 240.95993 148.3
[M+H-H2O]+ 184.99403 134.8
[M+HCOO]- 246.99497 152.8
[M+CH3COO]- 261.01062 153.6
[M+Na-2H]- 222.97144 140.5
[M]+ 201.99622 145.3
[M]- 201.99732 145.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.