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]+ 183.12404 141.3
[M+Na]+ 205.10598 148.4
[M-H]- 181.10948 139.8
[M+NH4]+ 200.15058 157.8
[M+K]+ 221.07992 145.4
[M+H-H2O]+ 165.11402 132.7
[M+HCOO]- 227.11496 156.1
[M+CH3COO]- 241.13061 151.9
[M+Na-2H]- 203.09143 146.0
[M]+ 182.11621 135.3
[M]- 182.11731 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.