CID 122761

2-(p-dimethylaminophenyl)quinoline

Structural Information

Molecular Formula
C17H16N2
SMILES
CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2
InChI
InChI=1S/C17H16N2/c1-19(2)15-10-7-14(8-11-15)17-12-9-13-5-3-4-6-16(13)18-17/h3-12H,1-2H3
InChIKey
KLNWLOCDPWWNDS-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-quinolin-2-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

665
Patents

248.13135 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.13863 156.9
[M+Na]+ 271.12057 164.7
[M-H]- 247.12407 164.4
[M+NH4]+ 266.16517 174.0
[M+K]+ 287.09451 160.4
[M+H-H2O]+ 231.12861 147.7
[M+HCOO]- 293.12955 180.1
[M+CH3COO]- 307.14520 169.4
[M+Na-2H]- 269.10602 164.8
[M]+ 248.13080 157.4
[M]- 248.13190 157.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe