CID 64334

Piperazine, 1-(1-adamantyl)-4-cyclopentyl-, dihydrochloride

Structural Information

Molecular Formula
C19H32N2
SMILES
C1CCC(C1)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4
InChI
InChI=1S/C19H32N2/c1-2-4-18(3-1)20-5-7-21(8-6-20)19-12-15-9-16(13-19)11-17(10-15)14-19/h15-18H,1-14H2
InChIKey
NWICYZXYBLYJMY-UHFFFAOYSA-N
Compound name
1-(1-adamantyl)-4-cyclopentylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.25656 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.263836 165.0
[M+Na]+ 311.245778 162.7
[M-H]- 287.249284 161.6
[M+NH4]+ 306.290383 185.4
[M+K]+ 327.219718 157.4
[M+H-H2O]+ 271.253820 153.5
[M+HCOO]- 333.254761 164.2
[M+CH3COO]- 347.270411 169.9
[M+Na-2H]- 309.231226 167.5
[M]+ 288.25601142 156.4
[M]- 288.25710858 156.4
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.