CID 73553580

933722-72-6

Structural Information

Molecular Formula
C6H4N2OS
SMILES
C1=CN2C=C(SC2=N1)C=O
InChI
InChI=1S/C6H4N2OS/c9-4-5-3-8-2-1-7-6(8)10-5/h1-4H
InChIKey
IIKJYOYXWBQCRZ-UHFFFAOYSA-N
Compound name
imidazo[2,1-b][1,3]thiazole-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

152.00444 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.01172 126.4
[M+Na]+ 174.99366 139.7
[M-H]- 150.99716 130.2
[M+NH4]+ 170.03826 150.9
[M+K]+ 190.96760 137.6
[M+H-H2O]+ 135.00170 121.2
[M+HCOO]- 197.00264 147.9
[M+CH3COO]- 211.01829 142.3
[M+Na-2H]- 172.97911 130.8
[M]+ 152.00389 132.0
[M]- 152.00499 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe