CID 15087818

4-amino-5h,6h,7h-cyclopenta[b]pyridin-2-ol

Structural Information

Molecular Formula
C8H10N2O
SMILES
C1CC2=C(C1)NC(=O)C=C2N
InChI
InChI=1S/C8H10N2O/c9-6-4-8(11)10-7-3-1-2-5(6)7/h4H,1-3H2,(H3,9,10,11)
InChIKey
BABNDIHHFOPOOI-UHFFFAOYSA-N
Compound name
4-amino-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.07932 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 128.1
[M+Na]+ 173.06854 137.2
[M-H]- 149.07204 130.0
[M+NH4]+ 168.11314 150.0
[M+K]+ 189.04248 133.6
[M+H-H2O]+ 133.07658 122.5
[M+HCOO]- 195.07752 150.3
[M+CH3COO]- 209.09317 173.7
[M+Na-2H]- 171.05399 134.1
[M]+ 150.07877 124.3
[M]- 150.07987 124.3
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.