CID 3058716

6-(1-phenylpropyl)-5,6,7,8-tetrahydro-1,6-naphthyridine

Structural Information

Molecular Formula
C17H20N2
SMILES
CCC(C1=CC=CC=C1)N2CCC3=C(C2)C=CC=N3
InChI
InChI=1S/C17H20N2/c1-2-17(14-7-4-3-5-8-14)19-12-10-16-15(13-19)9-6-11-18-16/h3-9,11,17H,2,10,12-13H2,1H3
InChIKey
YQSAGJDOGIZJBD-UHFFFAOYSA-N
Compound name
6-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

252.16264 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.16992 161.0
[M+Na]+ 275.15186 176.2
[M+NH4]+ 270.19646 170.7
[M+K]+ 291.12580 167.0
[M-H]- 251.15536 166.1
[M+Na-2H]- 273.13731 170.2
[M]+ 252.16209 164.8
[M]- 252.16319 164.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.