CID 44148339

97375-17-2

Structural Information

Molecular Formula
C39H41N
SMILES
CC(CC1=CC=CC=C1)C2=CC=C(C=C2)N(C3=CC=C(C=C3)C(C)CC4=CC=CC=C4)C(C)CC5=CC=CC=C5
InChI
InChI=1S/C39H41N/c1-30(27-33-13-7-4-8-14-33)36-19-23-38(24-20-36)40(32(3)29-35-17-11-6-12-18-35)39-25-21-37(22-26-39)31(2)28-34-15-9-5-10-16-34/h4-26,30-32H,27-29H2,1-3H3
InChIKey
OJNZEVPXRZRZID-UHFFFAOYSA-N
Compound name
N,4-bis(1-phenylpropan-2-yl)-N-[4-(1-phenylpropan-2-yl)phenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

523.3239 Da
Monoisotopic Mass

11.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 524.331176 237.5
[M+Na]+ 546.313118 236.2
[M-H]- 522.316624 250.5
[M+NH4]+ 541.357723 240.6
[M+K]+ 562.287058 228.5
[M+H-H2O]+ 506.321160 222.8
[M+HCOO]- 568.322101 254.2
[M+CH3COO]- 582.337751 241.8
[M+Na-2H]- 544.298566 233.7
[M]+ 523.32335142 235.2
[M]- 523.32444858 235.2
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.