CID 15087818

63704-54-1

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 128.6
[M+Na]+ 173.06854 139.8
[M+NH4]+ 168.11314 137.3
[M+K]+ 189.04248 135.9
[M-H]- 149.07204 130.1
[M+Na-2H]- 171.05399 133.5
[M]+ 150.07877 130.3
[M]- 150.07987 130.3
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.