CID 459604

Quinoline,2-(4-methoxyphenyl)-8-methyl-

Structural Information

Molecular Formula
C17H15NO
SMILES
CC1=C2C(=CC=C1)C=CC(=N2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C17H15NO/c1-12-4-3-5-14-8-11-16(18-17(12)14)13-6-9-15(19-2)10-7-13/h3-11H,1-2H3
InChIKey
ROHVLUAIQKOCGV-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-8-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

249.11537 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.12265 156.8
[M+Na]+ 272.10459 166.3
[M-H]- 248.10809 163.4
[M+NH4]+ 267.14919 173.9
[M+K]+ 288.07853 161.3
[M+H-H2O]+ 232.11263 148.1
[M+HCOO]- 294.11357 178.8
[M+CH3COO]- 308.12922 169.6
[M+Na-2H]- 270.09004 164.2
[M]+ 249.11482 158.6
[M]- 249.11592 158.6
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