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
2
Annotation Hits

3
References

1012
Patents

153.15175 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.15903 136.6
[M+Na]+ 176.14097 143.9
[M-H]- 152.14447 136.6
[M+NH4]+ 171.18557 163.3
[M+K]+ 192.11491 140.9
[M+H-H2O]+ 136.14901 132.2
[M+HCOO]- 198.14995 152.7
[M+CH3COO]- 212.16560 174.9
[M+Na-2H]- 174.12642 142.7
[M]+ 153.15120 132.2
[M]- 153.15230 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