CID 15689

1779-81-3

Structural Information

Molecular Formula
C3H6N2S
SMILES
C1CSC(=N1)N
InChI
InChI=1S/C3H6N2S/c4-3-5-1-2-6-3/h1-2H2,(H2,4,5)
InChIKey
REGFWZVTTFGQOJ-UHFFFAOYSA-N
Compound name
4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

61
References

3361
Patents

102.02517 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.032446 115.8
[M+Na]+ 125.014388 124.3
[M-H]- 101.017894 118.0
[M+NH4]+ 120.058993 139.4
[M+K]+ 140.988328 123.1
[M+H-H2O]+ 85.022430 110.1
[M+HCOO]- 147.023371 135.4
[M+CH3COO]- 161.039021 164.3
[M+Na-2H]- 122.999836 119.5
[M]+ 102.02462142 113.8
[M]- 102.02571858 113.8
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