CID 55374

Benzenamine, n,n'-((phenylborylene)bis(methylene))bis-

Structural Information

Molecular Formula
C20H21BN2
SMILES
B(CNC1=CC=CC=C1)(CNC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H21BN2/c1-4-10-18(11-5-1)21(16-22-19-12-6-2-7-13-19)17-23-20-14-8-3-9-15-20/h1-15,22-23H,16-17H2
InChIKey
FJGFCBUJNGYFKJ-UHFFFAOYSA-N
Compound name
N-[[anilinomethyl(phenyl)boranyl]methyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.17978 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.18706 175.5
[M+Na]+ 323.16900 190.1
[M+NH4]+ 318.21360 185.0
[M+K]+ 339.14294 179.7
[M-H]- 299.17250 184.5
[M+Na-2H]- 321.15445 188.4
[M]+ 300.17923 180.3
[M]- 300.18033 180.3
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.