CID 4418339

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

Structural Information

Molecular Formula
C9H8N2OS
SMILES
C1CC1C2=C(N3C=CSC3=N2)C=O
InChI
InChI=1S/C9H8N2OS/c12-5-7-8(6-1-2-6)10-9-11(7)3-4-13-9/h3-6H,1-2H2
InChIKey
DLXDDZCOOXLWAD-UHFFFAOYSA-N
Compound name
6-cyclopropylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.03574 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.04302 139.8
[M+Na]+ 215.02496 154.1
[M-H]- 191.02846 147.0
[M+NH4]+ 210.06956 157.7
[M+K]+ 230.99890 149.5
[M+H-H2O]+ 175.03300 134.0
[M+HCOO]- 237.03394 160.3
[M+CH3COO]- 251.04959 154.4
[M+Na-2H]- 213.01041 142.1
[M]+ 192.03519 147.3
[M]- 192.03629 147.3
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.