CID 63617658

2-[4-(2,2-diethoxyethyl)piperazin-1-yl]ethan-1-ol

Structural Information

Molecular Formula
C12H26N2O3
SMILES
CCOC(CN1CCN(CC1)CCO)OCC
InChI
InChI=1S/C12H26N2O3/c1-3-16-12(17-4-2)11-14-7-5-13(6-8-14)9-10-15/h12,15H,3-11H2,1-2H3
InChIKey
HFOAIKNMSXNXMK-UHFFFAOYSA-N
Compound name
2-[4-(2,2-diethoxyethyl)piperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.19434 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.20162 161.5
[M+Na]+ 269.18356 164.6
[M-H]- 245.18706 159.3
[M+NH4]+ 264.22816 175.3
[M+K]+ 285.15750 163.6
[M+H-H2O]+ 229.19160 153.4
[M+HCOO]- 291.19254 176.2
[M+CH3COO]- 305.20819 192.3
[M+Na-2H]- 267.16901 162.7
[M]+ 246.19379 161.5
[M]- 246.19489 161.5
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.