CID 53407152

1-[2-(2-methoxyethoxy)phenyl]piperazine dihydrochloride

Structural Information

Molecular Formula
C13H20N2O2
SMILES
COCCOC1=CC=CC=C1N2CCNCC2
InChI
InChI=1S/C13H20N2O2/c1-16-10-11-17-13-5-3-2-4-12(13)15-8-6-14-7-9-15/h2-5,14H,6-11H2,1H3
InChIKey
NFRLINULGVNEBU-UHFFFAOYSA-N
Compound name
1-[2-(2-methoxyethoxy)phenyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

236.15248 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.159756 155.7
[M+Na]+ 259.141698 159.9
[M-H]- 235.145204 156.9
[M+NH4]+ 254.186303 169.4
[M+K]+ 275.115638 156.7
[M+H-H2O]+ 219.149740 146.5
[M+HCOO]- 281.150681 172.3
[M+CH3COO]- 295.166331 188.0
[M+Na-2H]- 257.127146 160.1
[M]+ 236.15193142 152.4
[M]- 236.15302858 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

literature stripe

Patent stripe

patents stripe