CID 45462

63919-06-2

Structural Information

Molecular Formula
C23H25NO
SMILES
CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H25NO/c1-24(2)17-18-25-23(21-11-7-4-8-12-21)22-15-13-20(14-16-22)19-9-5-3-6-10-19/h3-16,23H,17-18H2,1-2H3
InChIKey
LJDGVCLTSKRXDS-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[phenyl-(4-phenylphenyl)methoxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.1936 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.200876 182.7
[M+Na]+ 354.182818 186.3
[M-H]- 330.186324 192.5
[M+NH4]+ 349.227423 195.7
[M+K]+ 370.156758 182.1
[M+H-H2O]+ 314.190860 172.3
[M+HCOO]- 376.191801 205.8
[M+CH3COO]- 390.207451 217.0
[M+Na-2H]- 352.168266 185.9
[M]+ 331.19305142 183.6
[M]- 331.19414858 183.6
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.