CID 54680447

7-amino-1,8-naphthyridine-2,4-diol

Structural Information

Molecular Formula
C8H7N3O2
SMILES
C1=CC(=NC2=C1C(=CC(=O)N2)O)N
InChI
InChI=1S/C8H7N3O2/c9-6-2-1-4-5(12)3-7(13)11-8(4)10-6/h1-3H,(H4,9,10,11,12,13)
InChIKey
YKWBJEGNZIUWLI-UHFFFAOYSA-N
Compound name
7-amino-4-hydroxy-1H-1,8-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

177.05383 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.06111 133.8
[M+Na]+ 200.04305 147.0
[M+NH4]+ 195.08765 141.0
[M+K]+ 216.01699 141.9
[M-H]- 176.04655 134.6
[M+Na-2H]- 198.02850 139.7
[M]+ 177.05328 135.7
[M]- 177.05438 135.7
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

patents stripe