CID 411694

Mcn 420

Structural Information

Molecular Formula
C24H34N2O6
SMILES
COC1=C(C(=CC=C1)OC)OCCN2CCN(CC2)CCOC3=C(C=CC=C3OC)OC
InChI
InChI=1S/C24H34N2O6/c1-27-19-7-5-8-20(28-2)23(19)31-17-15-25-11-13-26(14-12-25)16-18-32-24-21(29-3)9-6-10-22(24)30-4/h5-10H,11-18H2,1-4H3
InChIKey
JISAGXABLBLWAH-UHFFFAOYSA-N
Compound name
1,4-bis[2-(2,6-dimethoxyphenoxy)ethyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

446.2417 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 447.24898 209.5
[M+Na]+ 469.23092 213.1
[M-H]- 445.23442 215.1
[M+NH4]+ 464.27552 215.2
[M+K]+ 485.20486 210.7
[M+H-H2O]+ 429.23896 196.6
[M+HCOO]- 491.23990 225.4
[M+CH3COO]- 505.25555 232.2
[M+Na-2H]- 467.21637 208.4
[M]+ 446.24115 216.1
[M]- 446.24225 216.1
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.