CID 1535375

2-chloro-5-(4-methylpiperidine-1-carbonyl)pyridine

Structural Information

Molecular Formula
C12H15ClN2O
SMILES
CC1CCN(CC1)C(=O)C2=CN=C(C=C2)Cl
InChI
InChI=1S/C12H15ClN2O/c1-9-4-6-15(7-5-9)12(16)10-2-3-11(13)14-8-10/h2-3,8-9H,4-7H2,1H3
InChIKey
HFUXHFSZHKPOCB-UHFFFAOYSA-N
Compound name
(6-chloropyridin-3-yl)-(4-methylpiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.0873 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.09458 152.4
[M+Na]+ 261.07652 166.4
[M+NH4]+ 256.12112 160.9
[M+K]+ 277.05046 158.9
[M-H]- 237.08002 155.5
[M+Na-2H]- 259.06197 159.8
[M]+ 238.08675 155.5
[M]- 238.08785 155.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No patent data available for this compound.