CID 130116159

4-fluoro-1h,2h,3h-pyrrolo[3,4-c]pyridin-1-one

Structural Information

Molecular Formula
C7H5FN2O
SMILES
C1C2=C(C=CN=C2F)C(=O)N1
InChI
InChI=1S/C7H5FN2O/c8-6-5-3-10-7(11)4(5)1-2-9-6/h1-2H,3H2,(H,10,11)
InChIKey
QINOUGNANWYPHV-UHFFFAOYSA-N
Compound name
4-fluoro-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.03859 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.04587 126.4
[M+Na]+ 175.02781 136.9
[M-H]- 151.03131 126.1
[M+NH4]+ 170.07241 147.3
[M+K]+ 191.00175 133.3
[M+H-H2O]+ 135.03585 119.3
[M+HCOO]- 197.03679 146.1
[M+CH3COO]- 211.05244 140.0
[M+Na-2H]- 173.01326 132.8
[M]+ 152.03804 123.3
[M]- 152.03914 123.3
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.