CID 54521676

2,8-dimethyl-8-azabicyclo[3.2.1]octan-3-one

Structural Information

Molecular Formula
C9H15NO
SMILES
CC1C2CCC(N2C)CC1=O
InChI
InChI=1S/C9H15NO/c1-6-8-4-3-7(10(8)2)5-9(6)11/h6-8H,3-5H2,1-2H3
InChIKey
YQGGMUJPXGWROQ-UHFFFAOYSA-N
Compound name
2,8-dimethyl-8-azabicyclo[3.2.1]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

153.11537 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 133.2
[M+Na]+ 176.10459 143.9
[M+NH4]+ 171.14919 142.7
[M+K]+ 192.07853 139.4
[M-H]- 152.10809 133.8
[M+Na-2H]- 174.09004 135.1
[M]+ 153.11482 134.7
[M]- 153.11592 134.7
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