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]+ 144.05899 127.1
[M+Na]+ 166.04093 135.5
[M-H]- 142.04443 129.2
[M+NH4]+ 161.08553 148.7
[M+K]+ 182.01487 133.3
[M+H-H2O]+ 126.04897 120.9
[M+HCOO]- 188.04991 146.7
[M+CH3COO]- 202.06556 176.2
[M+Na-2H]- 164.02638 128.5
[M]+ 143.05116 125.2
[M]- 143.05226 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.