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

17
Patents

203.10587 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.11315 143.4
[M+Na]+ 226.09509 151.7
[M-H]- 202.09859 144.4
[M+NH4]+ 221.13969 157.0
[M+K]+ 242.06903 147.0
[M+H-H2O]+ 186.10313 128.6
[M+HCOO]- 248.10407 157.3
[M+CH3COO]- 262.11972 153.1
[M+Na-2H]- 224.08054 147.9
[M]+ 203.10532 133.7
[M]- 203.10642 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