CID 93609

Brn 0514047

Structural Information

Molecular Formula
C11H20N2O
SMILES
CC(C)C(=O)N1CC2CCN(C1C2)C
InChI
InChI=1S/C11H20N2O/c1-8(2)11(14)13-7-9-4-5-12(3)10(13)6-9/h8-10H,4-7H2,1-3H3
InChIKey
LAIXLKYAMLKEKK-UHFFFAOYSA-N
Compound name
2-methyl-1-(2-methyl-2,7-diazabicyclo[3.2.1]octan-7-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.15756 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.16484 148.5
[M+Na]+ 219.14678 154.3
[M-H]- 195.15028 148.0
[M+NH4]+ 214.19138 168.8
[M+K]+ 235.12072 152.7
[M+H-H2O]+ 179.15482 142.1
[M+HCOO]- 241.15576 162.7
[M+CH3COO]- 255.17141 187.3
[M+Na-2H]- 217.13223 149.2
[M]+ 196.15701 146.0
[M]- 196.15811 146.0
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.