CID 200870

Piperazine, 1,4-bis((4-methoxyphenoxy)acetyl)-

Structural Information

Molecular Formula
C22H26N2O6
SMILES
COC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)OC
InChI
InChI=1S/C22H26N2O6/c1-27-17-3-7-19(8-4-17)29-15-21(25)23-11-13-24(14-12-23)22(26)16-30-20-9-5-18(28-2)6-10-20/h3-10H,11-16H2,1-2H3
InChIKey
ZFNHZAHQXYCCTJ-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenoxy)-1-[4-[2-(4-methoxyphenoxy)acetyl]piperazin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

414.17908 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.18636 198.2
[M+Na]+ 437.16830 209.7
[M+NH4]+ 432.21290 202.5
[M+K]+ 453.14224 204.2
[M-H]- 413.17180 200.9
[M+Na-2H]- 435.15375 204.2
[M]+ 414.17853 200.2
[M]- 414.17963 200.2
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