CID 55255196

5-(1,3-dioxolan-2-yl)-1,3-thiazole

Structural Information

Molecular Formula
C6H7NO2S
SMILES
C1COC(O1)C2=CN=CS2
InChI
InChI=1S/C6H7NO2S/c1-2-9-6(8-1)5-3-7-4-10-5/h3-4,6H,1-2H2
InChIKey
RAJAQBUOYQZUEW-UHFFFAOYSA-N
Compound name
5-(1,3-dioxolan-2-yl)-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.01974 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.02702 129.1
[M+Na]+ 180.00896 140.0
[M+NH4]+ 175.05356 138.5
[M+K]+ 195.98290 136.9
[M-H]- 156.01246 134.2
[M+Na-2H]- 177.99441 133.9
[M]+ 157.01919 132.5
[M]- 157.02029 132.5
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

No patent data available for this compound.