CID 131037453

4-(1h-1,2,3-triazol-4-yl)piperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C7H12N4O
SMILES
C1CNCCC1(C2=NNN=C2)O
InChI
InChI=1S/C7H12N4O/c12-7(1-3-8-4-2-7)6-5-9-11-10-6/h5,8,12H,1-4H2,(H,9,10,11)
InChIKey
WHLYOKPDJLEMRO-UHFFFAOYSA-N
Compound name
4-(2H-triazol-4-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.1011 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.10838 137.3
[M+Na]+ 191.09032 146.9
[M+NH4]+ 186.13492 144.9
[M+K]+ 207.06426 142.5
[M-H]- 167.09382 136.5
[M+Na-2H]- 189.07577 143.5
[M]+ 168.10055 138.1
[M]- 168.10165 138.1
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.