CID 155973258

1,4-bis(methoxymethyl)-2-azabicyclo[2.1.1]hexane hydrochloride

Structural Information

Molecular Formula
C9H17NO2
SMILES
COCC12CC(C1)(NC2)COC
InChI
InChI=1S/C9H17NO2/c1-11-6-8-3-9(4-8,7-12-2)10-5-8/h10H,3-7H2,1-2H3
InChIKey
DMCRCZRVOZXCSG-UHFFFAOYSA-N
Compound name
1,4-bis(methoxymethyl)-2-azabicyclo[2.1.1]hexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.12593 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.13321 134.6
[M+Na]+ 194.11515 137.3
[M+NH4]+ 189.15975 142.4
[M+K]+ 210.08909 134.1
[M-H]- 170.11865 128.7
[M+Na-2H]- 192.10060 132.9
[M]+ 171.12538 132.1
[M]- 171.12648 132.1
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.