CID 3051143

67293-24-7

Structural Information

Molecular Formula
C23H32N2O2
SMILES
CCN(CCCCOC(=O)C1=CC=C(C=C1)N(C)C)CCC2=CC=CC=C2
InChI
InChI=1S/C23H32N2O2/c1-4-25(18-16-20-10-6-5-7-11-20)17-8-9-19-27-23(26)21-12-14-22(15-13-21)24(2)3/h5-7,10-15H,4,8-9,16-19H2,1-3H3
InChIKey
WWTVEZKDCGYLAC-UHFFFAOYSA-N
Compound name
4-[ethyl(2-phenylethyl)amino]butyl 4-(dimethylamino)benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.24637 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.25365 194.6
[M+Na]+ 391.23559 205.6
[M+NH4]+ 386.28019 201.5
[M+K]+ 407.20953 197.4
[M-H]- 367.23909 200.0
[M+Na-2H]- 389.22104 202.1
[M]+ 368.24582 197.6
[M]- 368.24692 197.6
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.