CID 24703151

6-(4-hydroxypiperidin-1-yl)pyridine-3-carbonitrile

Structural Information

Molecular Formula
C11H13N3O
SMILES
C1CN(CCC1O)C2=NC=C(C=C2)C#N
InChI
InChI=1S/C11H13N3O/c12-7-9-1-2-11(13-8-9)14-5-3-10(15)4-6-14/h1-2,8,10,15H,3-6H2
InChIKey
VDQFEUGDTPBSRH-UHFFFAOYSA-N
Compound name
6-(4-hydroxypiperidin-1-yl)pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

203.10587 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.113146 143.4
[M+Na]+ 226.095088 151.7
[M-H]- 202.098594 144.4
[M+NH4]+ 221.139693 157.0
[M+K]+ 242.069028 147.0
[M+H-H2O]+ 186.103130 128.6
[M+HCOO]- 248.104071 157.3
[M+CH3COO]- 262.119721 153.1
[M+Na-2H]- 224.080536 147.9
[M]+ 203.10532142 133.7
[M]- 203.10641858 133.7
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