CID 204973

Piperazine, 1,4-bis(methoxyacetyl)-

Structural Information

Molecular Formula
C10H18N2O4
SMILES
COCC(=O)N1CCN(CC1)C(=O)COC
InChI
InChI=1S/C10H18N2O4/c1-15-7-9(13)11-3-5-12(6-4-11)10(14)8-16-2/h3-8H2,1-2H3
InChIKey
ZJLBNKWCOGOOFP-UHFFFAOYSA-N
Compound name
2-methoxy-1-[4-(2-methoxyacetyl)piperazin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

230.12666 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.133936 152.0
[M+Na]+ 253.115878 156.9
[M-H]- 229.119384 151.9
[M+NH4]+ 248.160483 167.0
[M+K]+ 269.089818 157.0
[M+H-H2O]+ 213.123920 144.3
[M+HCOO]- 275.124861 168.6
[M+CH3COO]- 289.140511 188.8
[M+Na-2H]- 251.101326 153.8
[M]+ 230.12611142 152.4
[M]- 230.12720858 152.4
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