CID 126809506

2094444-43-4

Structural Information

Molecular Formula
C8H14N4O
SMILES
CN1C(=NC=N1)C2(CCNCC2)O
InChI
InChI=1S/C8H14N4O/c1-12-7(10-6-11-12)8(13)2-4-9-5-3-8/h6,9,13H,2-5H2,1H3
InChIKey
JLNGHOSDXPAGAH-UHFFFAOYSA-N
Compound name
4-(2-methyl-1,2,4-triazol-3-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.11676 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.124036 141.3
[M+Na]+ 205.105978 148.4
[M-H]- 181.109484 139.8
[M+NH4]+ 200.150583 157.8
[M+K]+ 221.079918 145.4
[M+H-H2O]+ 165.114020 132.7
[M+HCOO]- 227.114961 156.1
[M+CH3COO]- 241.130611 151.9
[M+Na-2H]- 203.091426 146.0
[M]+ 182.11621142 135.3
[M]- 182.11730858 135.3
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.