CID 18919602

8-(2-methoxyethyl)-8-azabicyclo[3.2.1]octan-3-one

Structural Information

Molecular Formula
C10H17NO2
SMILES
COCCN1C2CCC1CC(=O)C2
InChI
InChI=1S/C10H17NO2/c1-13-5-4-11-8-2-3-9(11)7-10(12)6-8/h8-9H,2-7H2,1H3
InChIKey
LDFYSYZSCOTFKV-UHFFFAOYSA-N
Compound name
8-(2-methoxyethyl)-8-azabicyclo[3.2.1]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

183.12593 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 141.2
[M+Na]+ 206.115148 147.8
[M-H]- 182.118654 142.1
[M+NH4]+ 201.159753 163.3
[M+K]+ 222.089088 146.1
[M+H-H2O]+ 166.123190 135.5
[M+HCOO]- 228.124131 159.3
[M+CH3COO]- 242.139781 182.5
[M+Na-2H]- 204.100596 145.1
[M]+ 183.12538142 140.6
[M]- 183.12647858 140.6
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