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]+ 289.26384 165.0
[M+Na]+ 311.24578 162.7
[M-H]- 287.24928 161.6
[M+NH4]+ 306.29038 185.4
[M+K]+ 327.21972 157.4
[M+H-H2O]+ 271.25382 153.5
[M+HCOO]- 333.25476 164.2
[M+CH3COO]- 347.27041 169.9
[M+Na-2H]- 309.23123 167.5
[M]+ 288.25601 156.4
[M]- 288.25711 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.