CID 3061498

2,6-piperidinedione, 4-(4-methoxyphenyl)-1-(3-(4-(3-methylphenyl)-1-piperazinyl)propyl)-

Structural Information

Molecular Formula
C26H33N3O3
SMILES
CC1=CC(=CC=C1)N2CCN(CC2)CCCN3C(=O)CC(CC3=O)C4=CC=C(C=C4)OC
InChI
InChI=1S/C26H33N3O3/c1-20-5-3-6-23(17-20)28-15-13-27(14-16-28)11-4-12-29-25(30)18-22(19-26(29)31)21-7-9-24(32-2)10-8-21/h3,5-10,17,22H,4,11-16,18-19H2,1-2H3
InChIKey
ROPJJJMIIANYAT-UHFFFAOYSA-N
Compound name
4-(4-methoxyphenyl)-1-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

435.2522 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 436.25948 212.5
[M+Na]+ 458.24142 215.6
[M-H]- 434.24492 219.0
[M+NH4]+ 453.28602 216.6
[M+K]+ 474.21536 208.9
[M+H-H2O]+ 418.24946 198.3
[M+HCOO]- 480.25040 223.0
[M+CH3COO]- 494.26605 231.7
[M+Na-2H]- 456.22687 208.3
[M]+ 435.25165 207.9
[M]- 435.25275 207.9
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.