CID 20482473

8-cyclopropyl-8-azabicyclo[3.2.1]octan-3-one

Structural Information

Molecular Formula
C10H15NO
SMILES
C1CC1N2C3CCC2CC(=O)C3
InChI
InChI=1S/C10H15NO/c12-10-5-8-3-4-9(6-10)11(8)7-1-2-7/h7-9H,1-6H2
InChIKey
LEMYNEZPTCSVOW-UHFFFAOYSA-N
Compound name
8-cyclopropyl-8-azabicyclo[3.2.1]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

165.11537 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 139.7
[M+Na]+ 188.10459 148.4
[M-H]- 164.10809 144.6
[M+NH4]+ 183.14919 157.4
[M+K]+ 204.07853 144.7
[M+H-H2O]+ 148.11263 133.3
[M+HCOO]- 210.11357 157.5
[M+CH3COO]- 224.12922 152.0
[M+Na-2H]- 186.09004 143.5
[M]+ 165.11482 138.7
[M]- 165.11592 138.7
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