CID 11159827

1-(adamantan-1-yl)cyclopropan-1-amine

Structural Information

Molecular Formula
C13H21N
SMILES
C1CC1(C23CC4CC(C2)CC(C4)C3)N
InChI
InChI=1S/C13H21N/c14-13(1-2-13)12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11H,1-8,14H2
InChIKey
POZBPBJYBOCXKL-UHFFFAOYSA-N
Compound name
1-(1-adamantyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.1674 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.17468 145.6
[M+Na]+ 214.15662 150.4
[M-H]- 190.16012 144.5
[M+NH4]+ 209.20122 168.0
[M+K]+ 230.13056 146.4
[M+H-H2O]+ 174.16466 138.5
[M+HCOO]- 236.16560 152.0
[M+CH3COO]- 250.18125 154.5
[M+Na-2H]- 212.14207 156.2
[M]+ 191.16685 145.3
[M]- 191.16795 145.3
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

No patent data available for this compound.