CID 130116159

1823952-90-4

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]+ 153.045866 126.4
[M+Na]+ 175.027808 136.9
[M-H]- 151.031314 126.1
[M+NH4]+ 170.072413 147.3
[M+K]+ 191.001748 133.3
[M+H-H2O]+ 135.035850 119.3
[M+HCOO]- 197.036791 146.1
[M+CH3COO]- 211.052441 140.0
[M+Na-2H]- 173.013256 132.8
[M]+ 152.03804142 123.3
[M]- 152.03913858 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.