CID 64181

19984-41-9

Structural Information

Molecular Formula
C16H28N2O
SMILES
C1CN(CCN1CCO)C23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C16H28N2O/c19-6-5-17-1-3-18(4-2-17)16-10-13-7-14(11-16)9-15(8-13)12-16/h13-15,19H,1-12H2
InChIKey
DRLUQEYOXPMXDQ-UHFFFAOYSA-N
Compound name
2-[4-(1-adamantyl)piperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.22015 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.22743 163.3
[M+Na]+ 287.20937 162.6
[M-H]- 263.21287 156.2
[M+NH4]+ 282.25397 182.8
[M+K]+ 303.18331 158.2
[M+H-H2O]+ 247.21741 153.3
[M+HCOO]- 309.21835 162.7
[M+CH3COO]- 323.23400 168.4
[M+Na-2H]- 285.19482 170.5
[M]+ 264.21960 158.1
[M]- 264.22070 158.1
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.