CID 3058696

1,6-naphthyridine, 5,6,7,8-tetrahydro-6-((3,4-dimethoxyphenyl)methyl)-

Structural Information

Molecular Formula
C17H20N2O2
SMILES
COC1=C(C=C(C=C1)CN2CCC3=C(C2)C=CC=N3)OC
InChI
InChI=1S/C17H20N2O2/c1-20-16-6-5-13(10-17(16)21-2)11-19-9-7-15-14(12-19)4-3-8-18-15/h3-6,8,10H,7,9,11-12H2,1-2H3
InChIKey
FGPOAVHUVMWZQN-UHFFFAOYSA-N
Compound name
6-[(3,4-dimethoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

284.15247 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.15975 167.7
[M+Na]+ 307.14169 183.0
[M+NH4]+ 302.18629 176.2
[M+K]+ 323.11563 174.4
[M-H]- 283.14519 172.0
[M+Na-2H]- 305.12714 175.7
[M]+ 284.15192 171.2
[M]- 284.15302 171.2
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