CID 204264

1-cyclohexyl-4-phenylpiperazine dihydrochloride

Structural Information

Molecular Formula
C16H24N2
SMILES
C1CCC(CC1)N2CCN(CC2)C3=CC=CC=C3
InChI
InChI=1S/C16H24N2/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2
InChIKey
NERTZMRMWNBNJK-UHFFFAOYSA-N
Compound name
1-cyclohexyl-4-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

244.19395 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.20123 160.7
[M+Na]+ 267.18317 162.3
[M-H]- 243.18667 165.1
[M+NH4]+ 262.22777 174.0
[M+K]+ 283.15711 158.0
[M+H-H2O]+ 227.19121 149.9
[M+HCOO]- 289.19215 174.2
[M+CH3COO]- 303.20780 169.3
[M+Na-2H]- 265.16862 163.0
[M]+ 244.19340 150.3
[M]- 244.19450 150.3
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