CID 503394

Gw 758x

Structural Information

Molecular Formula
C17H22N2O2
SMILES
CC(C)CC1=C(C2=C(C=CN=C2)NC1=O)OCC3CCC3
InChI
InChI=1S/C17H22N2O2/c1-11(2)8-13-16(21-10-12-4-3-5-12)14-9-18-7-6-15(14)19-17(13)20/h6-7,9,11-12H,3-5,8,10H2,1-2H3,(H,19,20)
InChIKey
QGOUESAYUXQAMM-UHFFFAOYSA-N
Compound name
4-(cyclobutylmethoxy)-3-(2-methylpropyl)-1H-1,6-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.17540 167.9
[M+Na]+ 309.15734 173.7
[M-H]- 285.16084 170.7
[M+NH4]+ 304.20194 174.9
[M+K]+ 325.13128 172.2
[M+H-H2O]+ 269.16538 153.7
[M+HCOO]- 331.16632 183.2
[M+CH3COO]- 345.18197 204.3
[M+Na-2H]- 307.14279 170.6
[M]+ 286.16757 176.7
[M]- 286.16867 176.7
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

No patent data available for this compound.