CID 23517938

169685-34-1

Structural Information

Molecular Formula
C40H36N2O2
SMILES
CC1=C(C=CC(=C1)OC)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=C(C=C(C=C6)OC)C
InChI
InChI=1S/C40H36N2O2/c1-29-27-37(43-3)23-25-39(29)41(33-11-7-5-8-12-33)35-19-15-31(16-20-35)32-17-21-36(22-18-32)42(34-13-9-6-10-14-34)40-26-24-38(44-4)28-30(40)2/h5-28H,1-4H3
InChIKey
HACXFZALVVMGPO-UHFFFAOYSA-N
Compound name
4-methoxy-N-[4-[4-(N-(4-methoxy-2-methylphenyl)anilino)phenyl]phenyl]-2-methyl-N-phenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

576.27765 Da
Monoisotopic Mass

10.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 577.28493 253.3
[M+Na]+ 599.26687 273.6
[M+NH4]+ 594.31147 261.8
[M+K]+ 615.24081 259.7
[M-H]- 575.27037 269.5
[M+Na-2H]- 597.25232 270.1
[M]+ 576.27710 261.5
[M]- 576.27820 261.5
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

patents stripe