CID 64237280

3-amino-1-(pyridin-3-yl)piperidin-2-one

Structural Information

Molecular Formula
C10H13N3O
SMILES
C1CC(C(=O)N(C1)C2=CN=CC=C2)N
InChI
InChI=1S/C10H13N3O/c11-9-4-2-6-13(10(9)14)8-3-1-5-12-7-8/h1,3,5,7,9H,2,4,6,11H2
InChIKey
CAAGMHVNSPQROG-UHFFFAOYSA-N
Compound name
3-amino-1-pyridin-3-ylpiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.10587 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.11315 142.2
[M+Na]+ 214.09509 148.8
[M-H]- 190.09859 145.3
[M+NH4]+ 209.13969 158.2
[M+K]+ 230.06903 145.5
[M+H-H2O]+ 174.10313 133.6
[M+HCOO]- 236.10407 161.7
[M+CH3COO]- 250.11972 184.0
[M+Na-2H]- 212.08054 147.3
[M]+ 191.10532 136.4
[M]- 191.10642 136.4
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

No patent data available for this compound.