CID 408322

1-methyl-2-phenyl-1,2-dihydroquinoline

Structural Information

Molecular Formula

C₁₆H₁₅N

SMILES

CN1C(C=CC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C16H15N/c1-17-15-10-6-5-9-14(15)11-12-16(17)13-7-3-2-4-8-13/h2-12,16H,1H3

InChIKey

QDGNTAWQJUIARL-UHFFFAOYSA-N

Compound name

1-methyl-2-phenyl-2H-quinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 221.12045 Da
Monoisotopic Mass: 4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	222.12773	150.4
[M+Na]+	244.10967	167.7
[M+NH4]+	239.15427	161.3
[M+K]+	260.08361	157.7
[M-H]-	220.11317	156.9
[M+Na-2H]-	242.09512	161.4
[M]+	221.11990	155.1
[M]-	221.12100	155.1

Literature stripe

literature stripe

Patent stripe

patents stripe