CID 24842197

Piperazine, 1-(o-methoxyphenyl)-4-(1-phenylcyclohexyl)-, dihydrobromide

Structural Information

Molecular Formula
C23H30N2O
SMILES
COC1=CC=CC=C1N2CCN(CC2)C3(CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C23H30N2O/c1-26-22-13-7-6-12-21(22)24-16-18-25(19-17-24)23(14-8-3-9-15-23)20-10-4-2-5-11-20/h2,4-7,10-13H,3,8-9,14-19H2,1H3
InChIKey
OUDHEUWHEMTCED-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)-4-(1-phenylcyclohexyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.24308 189.8
[M+Na]+ 373.22502 191.5
[M-H]- 349.22852 197.1
[M+NH4]+ 368.26962 200.2
[M+K]+ 389.19896 185.8
[M+H-H2O]+ 333.23306 176.5
[M+HCOO]- 395.23400 202.3
[M+CH3COO]- 409.24965 196.7
[M+Na-2H]- 371.21047 190.7
[M]+ 350.23525 180.9
[M]- 350.23635 180.9
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.