CID 24843774

91098-56-5

Structural Information

Molecular Formula
C25H35N3O2
SMILES
CCC(=O)N(C1=CC=C(C=C1)OC)C(C)CN2CCN(CC2)CCC3=CC=CC=C3
InChI
InChI=1S/C25H35N3O2/c1-4-25(29)28(23-10-12-24(30-3)13-11-23)21(2)20-27-18-16-26(17-19-27)15-14-22-8-6-5-7-9-22/h5-13,21H,4,14-20H2,1-3H3
InChIKey
JYJHWCWQQRPWIA-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.27292 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.28020 203.9
[M+Na]+ 432.26214 215.3
[M+NH4]+ 427.30674 210.0
[M+K]+ 448.23608 207.7
[M-H]- 408.26564 209.2
[M+Na-2H]- 430.24759 211.2
[M]+ 409.27237 206.9
[M]- 409.27347 206.9
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.