CID 120547

Piperazine, 1-(m-methoxyphenethyl)-4-phenyl-

Structural Information

Molecular Formula
C19H24N2O
SMILES
COC1=CC=CC(=C1)CCN2CCN(CC2)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2O/c1-22-19-9-5-6-17(16-19)10-11-20-12-14-21(15-13-20)18-7-3-2-4-8-18/h2-9,16H,10-15H2,1H3
InChIKey
SGEXRLPAQIRHGQ-UHFFFAOYSA-N
Compound name
1-[2-(3-methoxyphenyl)ethyl]-4-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19615 173.1
[M+Na]+ 319.17809 177.4
[M-H]- 295.18159 178.5
[M+NH4]+ 314.22269 184.7
[M+K]+ 335.15203 172.2
[M+H-H2O]+ 279.18613 161.8
[M+HCOO]- 341.18707 190.1
[M+CH3COO]- 355.20272 182.3
[M+Na-2H]- 317.16354 176.3
[M]+ 296.18832 169.8
[M]- 296.18942 169.8
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