CID 45051416

853333-44-5

Structural Information

Molecular Formula
C22H26N2O
SMILES
CC(C)N(C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC)C(C)C
InChI
InChI=1S/C22H26N2O/c1-15(2)24(16(3)4)22-14-21(17-10-12-18(25-5)13-11-17)23-20-9-7-6-8-19(20)22/h6-16H,1-5H3
InChIKey
WWTJEFUDRGQDTB-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-N,N-di(propan-2-yl)quinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.2045 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.211776 183.6
[M+Na]+ 357.193718 189.3
[M-H]- 333.197224 190.7
[M+NH4]+ 352.238323 197.1
[M+K]+ 373.167658 185.6
[M+H-H2O]+ 317.201760 173.6
[M+HCOO]- 379.202701 203.2
[M+CH3COO]- 393.218351 221.6
[M+Na-2H]- 355.179166 185.7
[M]+ 334.20395142 186.4
[M]- 334.20504858 186.4
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.