CID 826247

4-methoxy-2-phenylquinoline

Structural Information

Molecular Formula
C16H13NO
SMILES
COC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C16H13NO/c1-18-16-11-15(12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16/h2-11H,1H3
InChIKey
CVJHRDUVYHASOG-UHFFFAOYSA-N
Compound name
4-methoxy-2-phenylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

73
Patents

235.09972 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10700 152.0
[M+Na]+ 258.08894 161.0
[M-H]- 234.09244 158.4
[M+NH4]+ 253.13354 169.3
[M+K]+ 274.06288 156.2
[M+H-H2O]+ 218.09698 143.3
[M+HCOO]- 280.09792 174.3
[M+CH3COO]- 294.11357 164.8
[M+Na-2H]- 256.07439 160.7
[M]+ 235.09917 153.0
[M]- 235.10027 153.0
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.