CID 420932

4-chloropiperidine

Structural Information

Molecular Formula
C5H10ClN
SMILES
C1CNCCC1Cl
InChI
InChI=1S/C5H10ClN/c6-5-1-3-7-4-2-5/h5,7H,1-4H2
InChIKey
GBPBXBUHZSOKTH-UHFFFAOYSA-N
Compound name
4-chloropiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

390
Patents

119.05018 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.05746 122.7
[M+Na]+ 142.03940 128.9
[M-H]- 118.04290 122.6
[M+NH4]+ 137.08400 143.6
[M+K]+ 158.01334 125.8
[M+H-H2O]+ 102.04744 117.8
[M+HCOO]- 164.04838 136.7
[M+CH3COO]- 178.06403 164.3
[M+Na-2H]- 140.02485 129.0
[M]+ 119.04963 117.1
[M]- 119.05073 117.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe