CID 3040137

Dpa 304

Structural Information

Molecular Formula
C22H22ClN
SMILES
CC(C(C1=CC=CC=C1)C2=CC=CC=C2)NCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C22H22ClN/c1-17(24-16-18-12-14-21(23)15-13-18)22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,17,22,24H,16H2,1H3
InChIKey
ZMZVJDHVNRNRLY-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)methyl]-1,1-diphenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.14407 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.15135 181.3
[M+Na]+ 358.13329 186.0
[M-H]- 334.13679 189.6
[M+NH4]+ 353.17789 194.5
[M+K]+ 374.10723 178.6
[M+H-H2O]+ 318.14133 172.3
[M+HCOO]- 380.14227 198.6
[M+CH3COO]- 394.15792 191.0
[M+Na-2H]- 356.11874 184.2
[M]+ 335.14352 181.3
[M]- 335.14462 181.3
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.