CID 75355610

4-(1h-pyrazol-5-ylmethyl)piperidine

Structural Information

Molecular Formula
C9H15N3
SMILES
C1CNCCC1CC2=CC=NN2
InChI
InChI=1S/C9H15N3/c1-4-10-5-2-8(1)7-9-3-6-11-12-9/h3,6,8,10H,1-2,4-5,7H2,(H,11,12)
InChIKey
LYBNJMYVPOSXLA-UHFFFAOYSA-N
Compound name
4-(1H-pyrazol-5-ylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

165.1266 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 138.2
[M+Na]+ 188.115818 142.9
[M-H]- 164.119324 137.0
[M+NH4]+ 183.160423 154.4
[M+K]+ 204.089758 139.1
[M+H-H2O]+ 148.123860 129.4
[M+HCOO]- 210.124801 153.6
[M+CH3COO]- 224.140451 148.4
[M+Na-2H]- 186.101266 142.1
[M]+ 165.12605142 129.8
[M]- 165.12714858 129.8
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

patents stripe