CID 408394

8-methyl-8-azabicyclo[3.2.1]octan-3-amine

Structural Information

Molecular Formula
C8H16N2
SMILES
CN1C2CCC1CC(C2)N
InChI
InChI=1S/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3
InChIKey
HJGMRAKQWLKWMH-UHFFFAOYSA-N
Compound name
8-methyl-8-azabicyclo[3.2.1]octan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1344
Patents

140.13135 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.13863 131.0
[M+Na]+ 163.12057 137.5
[M-H]- 139.12407 131.7
[M+NH4]+ 158.16517 154.5
[M+K]+ 179.09451 135.5
[M+H-H2O]+ 123.12861 125.5
[M+HCOO]- 185.12955 149.6
[M+CH3COO]- 199.14520 177.4
[M+Na-2H]- 161.10602 135.3
[M]+ 140.13080 125.8
[M]- 140.13190 125.8
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

patents stripe