CID 12198067

2-(4-(2-phenoxyethyl)-1-piperazinyl)ethanol

Structural Information

Molecular Formula
C14H22N2O2
SMILES
C1CN(CCN1CCO)CCOC2=CC=CC=C2
InChI
InChI=1S/C14H22N2O2/c17-12-10-15-6-8-16(9-7-15)11-13-18-14-4-2-1-3-5-14/h1-5,17H,6-13H2
InChIKey
CYLWDKPECYZKKY-UHFFFAOYSA-N
Compound name
2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.16812 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.17540 160.1
[M+Na]+ 273.15734 163.9
[M-H]- 249.16084 161.1
[M+NH4]+ 268.20194 173.3
[M+K]+ 289.13128 160.5
[M+H-H2O]+ 233.16538 150.7
[M+HCOO]- 295.16632 176.3
[M+CH3COO]- 309.18197 191.0
[M+Na-2H]- 271.14279 164.0
[M]+ 250.16757 157.2
[M]- 250.16867 157.2
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