CID 19795979

{1-azabicyclo[3.2.1]octan-5-yl}methanamine dihydrochloride

Structural Information

Molecular Formula
C8H16N2
SMILES
C1CC2(CCN(C1)C2)CN
InChI
InChI=1S/C8H16N2/c9-6-8-2-1-4-10(7-8)5-3-8/h1-7,9H2
InChIKey
IFRPDNADNWKYLD-UHFFFAOYSA-N
Compound name
1-azabicyclo[3.2.1]octan-5-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

140.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.138626 130.9
[M+Na]+ 163.120568 136.5
[M-H]- 139.124074 131.2
[M+NH4]+ 158.165173 155.8
[M+K]+ 179.094508 134.6
[M+H-H2O]+ 123.128610 125.3
[M+HCOO]- 185.129551 149.6
[M+CH3COO]- 199.145201 143.3
[M+Na-2H]- 161.106016 137.6
[M]+ 140.13080142 125.2
[M]- 140.13189858 125.2
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

patents stripe