CID 459659

Oprea1_146524

Structural Information

Molecular Formula
C18H18N2
SMILES
CC1=CC2=C(C=C1)N=C(C=C2)C3=CC=C(C=C3)N(C)C
InChI
InChI=1S/C18H18N2/c1-13-4-10-18-15(12-13)7-11-17(19-18)14-5-8-16(9-6-14)20(2)3/h4-12H,1-3H3
InChIKey
RWZFLILFUOBPIQ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(6-methylquinolin-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

262.147 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.15428 161.7
[M+Na]+ 285.13622 170.1
[M-H]- 261.13972 169.5
[M+NH4]+ 280.18082 178.6
[M+K]+ 301.11016 165.6
[M+H-H2O]+ 245.14426 152.5
[M+HCOO]- 307.14520 184.7
[M+CH3COO]- 321.16085 174.2
[M+Na-2H]- 283.12167 168.3
[M]+ 262.14645 163.0
[M]- 262.14755 163.0
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.