CID 3064607

1-propanone, 1-(4-aminophenyl)-3-(bis(phenylmethyl)amino)-, monohydrochloride

Structural Information

Molecular Formula
C23H24N2O
SMILES
C1=CC=C(C=C1)CN(CCC(=O)C2=CC=C(C=C2)N)CC3=CC=CC=C3
InChI
InChI=1S/C23H24N2O/c24-22-13-11-21(12-14-22)23(26)15-16-25(17-19-7-3-1-4-8-19)18-20-9-5-2-6-10-20/h1-14H,15-18,24H2
InChIKey
FVFMZLIHXNHPBQ-UHFFFAOYSA-N
Compound name
1-(4-aminophenyl)-3-(dibenzylamino)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.18887 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.196146 185.3
[M+Na]+ 367.178088 188.4
[M-H]- 343.181594 194.6
[M+NH4]+ 362.222693 197.1
[M+K]+ 383.152028 183.2
[M+H-H2O]+ 327.186130 174.7
[M+HCOO]- 389.187071 209.0
[M+CH3COO]- 403.202721 220.6
[M+Na-2H]- 365.163536 188.1
[M]+ 344.18832142 184.0
[M]- 344.18941858 184.0
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.