CID 204262

1,4-dicyclohexylpiperazine dihydrochloride

Structural Information

Molecular Formula
C16H30N2
SMILES
C1CCC(CC1)N2CCN(CC2)C3CCCCC3
InChI
InChI=1S/C16H30N2/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h15-16H,1-14H2
InChIKey
PMKYZLGUIDMJBM-UHFFFAOYSA-N
Compound name
1,4-dicyclohexylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

98
Patents

250.2409 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.248176 166.2
[M+Na]+ 273.230118 164.6
[M-H]- 249.233624 169.4
[M+NH4]+ 268.274723 178.9
[M+K]+ 289.204058 161.1
[M+H-H2O]+ 233.238160 155.1
[M+HCOO]- 295.239101 175.3
[M+CH3COO]- 309.254751 172.9
[M+Na-2H]- 271.215566 165.2
[M]+ 250.24035142 151.5
[M]- 250.24144858 151.5
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