CID 214870

34544-69-9

Structural Information

Molecular Formula
C4H7N3OS
SMILES
CN(C1=NC(=O)CS1)N
InChI
InChI=1S/C4H7N3OS/c1-7(5)4-6-3(8)2-9-4/h2,5H2,1H3
InChIKey
PIEAUKSLZUCGQX-UHFFFAOYSA-N
Compound name
2-[amino(methyl)amino]-1,3-thiazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.03099 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.03827 128.0
[M+Na]+ 168.02021 136.4
[M+NH4]+ 163.06481 136.2
[M+K]+ 183.99415 132.3
[M-H]- 144.02371 129.6
[M+Na-2H]- 166.00566 132.1
[M]+ 145.03044 129.7
[M]- 145.03154 129.7
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.