CID 137935662

2253629-50-2

Structural Information

Molecular Formula
C8H15NO
SMILES
CC12CCC(CC1)(CO2)N
InChI
InChI=1S/C8H15NO/c1-7-2-4-8(9,5-3-7)6-10-7/h2-6,9H2,1H3
InChIKey
JLVUAMOZHBDOTJ-UHFFFAOYSA-N
Compound name
1-methyl-2-oxabicyclo[2.2.2]octan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

141.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 130.0
[M+Na]+ 164.10459 139.4
[M+NH4]+ 159.14919 144.2
[M+K]+ 180.07853 129.4
[M-H]- 140.10809 130.5
[M+Na-2H]- 162.09004 131.2
[M]+ 141.11482 131.7
[M]- 141.11592 131.7
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