CID 97169

6-(3-methoxypropyl)-8-oxa-6-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula
C10H19NO2
SMILES
COCCCN1CC2CCCC1O2
InChI
InChI=1S/C10H19NO2/c1-12-7-3-6-11-8-9-4-2-5-10(11)13-9/h9-10H,2-8H2,1H3
InChIKey
COAHPTZTTPSBPB-UHFFFAOYSA-N
Compound name
6-(3-methoxypropyl)-8-oxa-6-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.14159 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 142.1
[M+Na]+ 208.13081 147.6
[M-H]- 184.13431 143.2
[M+NH4]+ 203.17541 162.7
[M+K]+ 224.10475 147.4
[M+H-H2O]+ 168.13885 136.1
[M+HCOO]- 230.13979 159.1
[M+CH3COO]- 244.15544 182.2
[M+Na-2H]- 206.11626 147.4
[M]+ 185.14104 142.4
[M]- 185.14214 142.4
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

No patent data available for this compound.