CID 71695443

3-(3-phenyl-1h-pyrazol-5-yl)piperidine dihydrochloride

Structural Information

Molecular Formula
C14H17N3
SMILES
C1CC(CNC1)C2=CC(=NN2)C3=CC=CC=C3
InChI
InChI=1S/C14H17N3/c1-2-5-11(6-3-1)13-9-14(17-16-13)12-7-4-8-15-10-12/h1-3,5-6,9,12,15H,4,7-8,10H2,(H,16,17)
InChIKey
QBZXVBLHBBDFGS-UHFFFAOYSA-N
Compound name
3-(3-phenyl-1H-pyrazol-5-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.14224 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.14952 154.8
[M+Na]+ 250.13146 167.5
[M+NH4]+ 245.17606 162.9
[M+K]+ 266.10540 161.8
[M-H]- 226.13496 158.6
[M+Na-2H]- 248.11691 163.2
[M]+ 227.14169 157.5
[M]- 227.14279 157.5
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.

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No patent data available for this compound.