CID 472399

Oprea1_463109

Structural Information

Molecular Formula
C17H16N2
SMILES
CC1=C2C(=CC=C1)C(=CC(=N2)NC3=CC=CC=C3)C
InChI
InChI=1S/C17H16N2/c1-12-7-6-10-15-13(2)11-16(19-17(12)15)18-14-8-4-3-5-9-14/h3-11H,1-2H3,(H,18,19)
InChIKey
VHHHLGUMICHYCQ-UHFFFAOYSA-N
Compound name
4,8-dimethyl-N-phenylquinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.13135 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.13863 157.0
[M+Na]+ 271.12057 165.8
[M-H]- 247.12407 163.5
[M+NH4]+ 266.16517 173.8
[M+K]+ 287.09451 160.0
[M+H-H2O]+ 231.12861 148.2
[M+HCOO]- 293.12955 179.8
[M+CH3COO]- 307.14520 169.4
[M+Na-2H]- 269.10602 165.0
[M]+ 248.13080 156.8
[M]- 248.13190 156.8
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.