CID 589680

1,5-naphthyridin-2-ol

Structural Information

Molecular Formula
C8H6N2O
SMILES
C1=CC2=C(C=CC(=O)N2)N=C1
InChI
InChI=1S/C8H6N2O/c11-8-4-3-6-7(10-8)2-1-5-9-6/h1-5H,(H,10,11)
InChIKey
OJFSCKNLUYOABN-UHFFFAOYSA-N
Compound name
1H-1,5-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

610
Patents

146.04802 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.05530 125.5
[M+Na]+ 169.03724 135.7
[M-H]- 145.04074 126.5
[M+NH4]+ 164.08184 144.7
[M+K]+ 185.01118 131.9
[M+H-H2O]+ 129.04528 118.7
[M+HCOO]- 191.04622 146.6
[M+CH3COO]- 205.06187 139.3
[M+Na-2H]- 167.02269 136.5
[M]+ 146.04747 124.2
[M]- 146.04857 124.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe