CID 381397

5-amino-2-(methylamino)-1,3-thiazole-4-carboxamide

Structural Information

Molecular Formula
C5H8N4OS
SMILES
CNC1=NC(=C(S1)N)C(=O)N
InChI
InChI=1S/C5H8N4OS/c1-8-5-9-2(3(6)10)4(7)11-5/h7H2,1H3,(H2,6,10)(H,8,9)
InChIKey
AUUMSCGUNURINM-UHFFFAOYSA-N
Compound name
5-amino-2-(methylamino)-1,3-thiazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.04189 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.04917 132.6
[M+Na]+ 195.03111 141.0
[M-H]- 171.03461 135.0
[M+NH4]+ 190.07571 152.7
[M+K]+ 211.00505 138.5
[M+H-H2O]+ 155.03915 125.9
[M+HCOO]- 217.04009 153.5
[M+CH3COO]- 231.05574 183.8
[M+Na-2H]- 193.01656 134.0
[M]+ 172.04134 131.0
[M]- 172.04244 131.0
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.