CID 88987015

2-methyl-8-azabicyclo[3.2.1]octan-3-one hydrochloride

Structural Information

Molecular Formula
C8H13NO
SMILES
CC1C2CCC(N2)CC1=O
InChI
InChI=1S/C8H13NO/c1-5-7-3-2-6(9-7)4-8(5)10/h5-7,9H,2-4H2,1H3
InChIKey
QGZPOIOGWQCRBQ-UHFFFAOYSA-N
Compound name
2-methyl-8-azabicyclo[3.2.1]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

139.09972 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.10700 129.5
[M+Na]+ 162.08894 139.3
[M+NH4]+ 157.13354 138.7
[M+K]+ 178.06288 135.2
[M-H]- 138.09244 129.5
[M+Na-2H]- 160.07439 131.2
[M]+ 139.09917 130.5
[M]- 139.10027 130.5
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