CID 453048

1,2-ethanediamine, n,n-dimethyl-n'-(2-phenyl-4-quinolinyl)-

Structural Information

Molecular Formula
C19H21N3
SMILES
CN(C)CCNC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C19H21N3/c1-22(2)13-12-20-19-14-18(15-8-4-3-5-9-15)21-17-11-7-6-10-16(17)19/h3-11,14H,12-13H2,1-2H3,(H,20,21)
InChIKey
QWAVSGXBYFASKZ-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-N-(2-phenylquinolin-4-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

11
Patents

291.17355 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.18083 169.3
[M+Na]+ 314.16277 175.4
[M-H]- 290.16627 176.4
[M+NH4]+ 309.20737 184.2
[M+K]+ 330.13671 170.6
[M+H-H2O]+ 274.17081 159.3
[M+HCOO]- 336.17175 192.9
[M+CH3COO]- 350.18740 180.4
[M+Na-2H]- 312.14822 176.7
[M]+ 291.17300 169.9
[M]- 291.17410 169.9
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