CID 200695

2532-86-7

Structural Information

Molecular Formula
C16H20FNO2
SMILES
CN1C2CCC1CC(C2)OC(=O)CC3=CC=CC=C3F
InChI
InChI=1S/C16H20FNO2/c1-18-12-6-7-13(18)10-14(9-12)20-16(19)8-11-4-2-3-5-15(11)17/h2-5,12-14H,6-10H2,1H3
InChIKey
UMFWMIAAZDHZEW-UHFFFAOYSA-N
Compound name
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-fluorophenyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1478 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.15508 166.1
[M+Na]+ 300.13702 176.3
[M+NH4]+ 295.18162 174.0
[M+K]+ 316.11096 171.2
[M-H]- 276.14052 166.9
[M+Na-2H]- 298.12247 168.6
[M]+ 277.14725 167.5
[M]- 277.14835 167.5
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

No patent data available for this compound.