CID 210432

21263-05-8

Structural Information

Molecular Formula
C23H30N2O2
SMILES
CC(CN1CCN(CC1)CC(C2=CC=CC=C2)OC)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H30N2O2/c1-19(23(26)21-11-7-4-8-12-21)17-24-13-15-25(16-14-24)18-22(27-2)20-9-5-3-6-10-20/h3-12,19,22H,13-18H2,1-2H3
InChIKey
SGGBVTPQLWEREB-UHFFFAOYSA-N
Compound name
3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]-2-methyl-1-phenylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.23074 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.23802 191.8
[M+Na]+ 389.21996 204.0
[M+NH4]+ 384.26456 198.5
[M+K]+ 405.19390 196.5
[M-H]- 365.22346 196.4
[M+Na-2H]- 387.20541 199.5
[M]+ 366.23019 194.7
[M]- 366.23129 194.7
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

No patent data available for this compound.