CID 95377684

4-[(1r)-1-aminoethyl]-1,3-thiazol-2-amine dihydrochloride

Structural Information

Molecular Formula
C5H9N3S
SMILES
C[C@H](C1=CSC(=N1)N)N
InChI
InChI=1S/C5H9N3S/c1-3(6)4-2-9-5(7)8-4/h2-3H,6H2,1H3,(H2,7,8)/t3-/m1/s1
InChIKey
XHRDXPTWYNDGKL-GSVOUGTGSA-N
Compound name
4-[(1R)-1-aminoethyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.05171 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.058986 127.1
[M+Na]+ 166.040928 135.5
[M-H]- 142.044434 129.2
[M+NH4]+ 161.085533 148.7
[M+K]+ 182.014868 133.3
[M+H-H2O]+ 126.048970 120.9
[M+HCOO]- 188.049911 146.7
[M+CH3COO]- 202.065561 176.2
[M+Na-2H]- 164.026376 128.5
[M]+ 143.05116142 125.2
[M]- 143.05225858 125.2
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.