CID 22019755

119344-86-4

Structural Information

Molecular Formula
C24H32N2O2
SMILES
CCC(CC1=CC=C(C=C1)C)(C(=O)C2=CC=C(C=C2)N3CCOCC3)N(C)C
InChI
InChI=1S/C24H32N2O2/c1-5-24(25(3)4,18-20-8-6-19(2)7-9-20)23(27)21-10-12-22(13-11-21)26-14-16-28-17-15-26/h6-13H,5,14-18H2,1-4H3
InChIKey
PUBNJSZGANKUGX-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-(4-morpholin-4-ylphenyl)butan-1-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

16769
Patents

380.24637 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.25365 195.9
[M+Na]+ 403.23559 208.2
[M+NH4]+ 398.28019 202.9
[M+K]+ 419.20953 201.2
[M-H]- 379.23909 203.0
[M+Na-2H]- 401.22104 203.7
[M]+ 380.24582 199.7
[M]- 380.24692 199.7
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

patents stripe