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]+ 141.13863 130.9
[M+Na]+ 163.12057 136.5
[M-H]- 139.12407 131.2
[M+NH4]+ 158.16517 155.8
[M+K]+ 179.09451 134.6
[M+H-H2O]+ 123.12861 125.3
[M+HCOO]- 185.12955 149.6
[M+CH3COO]- 199.14520 143.3
[M+Na-2H]- 161.10602 137.6
[M]+ 140.13080 125.2
[M]- 140.13190 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