CID 120269

Thiazoline

Structural Information

Molecular Formula
C3H5NS
SMILES
C1CSC=N1
InChI
InChI=1S/C3H5NS/c1-2-5-3-4-1/h3H,1-2H2
InChIKey
CBDKQYKMCICBOF-UHFFFAOYSA-N
Compound name
4,5-dihydro-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

118
References

40337
Patents

87.01427 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.021546 113.6
[M+Na]+ 110.00349 124.7
[M+NH4]+ 105.04809 123.9
[M+K]+ 125.97743 118.3
[M-H]- 86.006994 115.5
[M+Na-2H]- 107.98894 119.7
[M]+ 87.013721 116.0
[M]- 87.014819 116.0
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