CID 41797

1-(m-methoxyphenyl)-6-methyl-6-azabicyclo(3.2.1)octane hydrobromide

Structural Information

Molecular Formula
C15H21NO
SMILES
CN1CC2(CCCC1C2)C3=CC(=CC=C3)OC
InChI
InChI=1S/C15H21NO/c1-16-11-15(8-4-6-13(16)10-15)12-5-3-7-14(9-12)17-2/h3,5,7,9,13H,4,6,8,10-11H2,1-2H3
InChIKey
ORHIDWGJUMDDCY-UHFFFAOYSA-N
Compound name
1-(3-methoxyphenyl)-6-methyl-6-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

231.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.16959 155.3
[M+Na]+ 254.15153 167.5
[M+NH4]+ 249.19613 166.8
[M+K]+ 270.12547 159.3
[M-H]- 230.15503 158.8
[M+Na-2H]- 252.13698 161.7
[M]+ 231.16176 158.2
[M]- 231.16286 158.2
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