CID 84716228

1-azabicyclo[3.3.1]nonan-5-amine dihydrochloride

Structural Information

Molecular Formula
C8H16N2
SMILES
C1CC2(CCCN(C1)C2)N
InChI
InChI=1S/C8H16N2/c9-8-3-1-5-10(7-8)6-2-4-8/h1-7,9H2
InChIKey
JTTKVQILGZKXRW-UHFFFAOYSA-N
Compound name
1-azabicyclo[3.3.1]nonan-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.13863 130.7
[M+Na]+ 163.12057 135.3
[M-H]- 139.12407 130.7
[M+NH4]+ 158.16517 153.7
[M+K]+ 179.09451 133.6
[M+H-H2O]+ 123.12861 124.7
[M+HCOO]- 185.12955 147.1
[M+CH3COO]- 199.14520 142.3
[M+Na-2H]- 161.10602 138.9
[M]+ 140.13080 122.8
[M]- 140.13190 122.8
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.