CID 104053454

4-(2-amino-1,3-thiazol-5-yl)piperidin-4-ol

Structural Information

Molecular Formula
C8H13N3OS
SMILES
C1CNCCC1(C2=CN=C(S2)N)O
InChI
InChI=1S/C8H13N3OS/c9-7-11-5-6(13-7)8(12)1-3-10-4-2-8/h5,10,12H,1-4H2,(H2,9,11)
InChIKey
BNDSTVWYIAIBCZ-UHFFFAOYSA-N
Compound name
4-(2-amino-1,3-thiazol-5-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.07793 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08521 140.5
[M+Na]+ 222.06715 149.1
[M+NH4]+ 217.11175 149.7
[M+K]+ 238.04109 142.6
[M-H]- 198.07065 142.2
[M+Na-2H]- 220.05260 146.5
[M]+ 199.07738 142.4
[M]- 199.07848 142.4
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.