CID 137944770

3-cyclohexylbicyclo[1.1.1]pentan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H19N
SMILES
C1CCC(CC1)C23CC(C2)(C3)N
InChI
InChI=1S/C11H19N/c12-11-6-10(7-11,8-11)9-4-2-1-3-5-9/h9H,1-8,12H2
InChIKey
UIWJFQOJVLNNSB-UHFFFAOYSA-N
Compound name
3-cyclohexylbicyclo[1.1.1]pentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.15175 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.159026 151.4
[M+Na]+ 188.140968 153.6
[M-H]- 164.144474 155.9
[M+NH4]+ 183.185573 157.5
[M+K]+ 204.114908 158.4
[M+H-H2O]+ 148.149010 137.2
[M+HCOO]- 210.149951 162.5
[M+CH3COO]- 224.165601 208.9
[M+Na-2H]- 186.126416 156.8
[M]+ 165.15120142 170.7
[M]- 165.15229858 170.7
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.