CID 103787

1,3,3-trimethyl-6-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula
C10H19N
SMILES
CC1(CC2CC(C1)(CN2)C)C
InChI
InChI=1S/C10H19N/c1-9(2)4-8-5-10(3,6-9)7-11-8/h8,11H,4-7H2,1-3H3
InChIKey
FRAKHUZTNLUGPB-UHFFFAOYSA-N
Compound name
1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

1049
Patents

153.15175 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.159026 136.6
[M+Na]+ 176.140968 143.9
[M-H]- 152.144474 136.6
[M+NH4]+ 171.185573 163.3
[M+K]+ 192.114908 140.9
[M+H-H2O]+ 136.149010 132.2
[M+HCOO]- 198.149951 152.7
[M+CH3COO]- 212.165601 174.9
[M+Na-2H]- 174.126416 142.7
[M]+ 153.15120142 132.2
[M]- 153.15229858 132.2
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