CID 460677

Chembl69921

Structural Information

Molecular Formula
C25H24N2
SMILES
CN(CC1=CC=C(C=C1)NC2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C25H24N2/c1-27(19-22-10-7-9-21-8-5-6-13-25(21)22)18-20-14-16-24(17-15-20)26-23-11-3-2-4-12-23/h2-17,26H,18-19H2,1H3
InChIKey
ZTIMEBPQFOIXEO-UHFFFAOYSA-N
Compound name
4-[[methyl(naphthalen-1-ylmethyl)amino]methyl]-N-phenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

352.19394 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.20122 185.8
[M+Na]+ 375.18316 190.4
[M-H]- 351.18666 196.4
[M+NH4]+ 370.22776 198.7
[M+K]+ 391.15710 183.9
[M+H-H2O]+ 335.19120 174.8
[M+HCOO]- 397.19214 209.6
[M+CH3COO]- 411.20779 195.6
[M+Na-2H]- 373.16861 192.1
[M]+ 352.19339 185.0
[M]- 352.19449 185.0
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

No patent data available for this compound.