CID 168025111

Akos040805483

Structural Information

Molecular Formula
C10H16FNO2
SMILES
C1CNCCC12CC(C2)C(C(=O)O)F
InChI
InChI=1S/C10H16FNO2/c11-8(9(13)14)7-5-10(6-7)1-3-12-4-2-10/h7-8,12H,1-6H2,(H,13,14)
InChIKey
FPSAVMJPAUKZMB-UHFFFAOYSA-N
Compound name
2-(7-azaspiro[3.5]nonan-2-yl)-2-fluoroacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.1165 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.12378 146.8
[M+Na]+ 224.10572 149.4
[M-H]- 200.10922 145.9
[M+NH4]+ 219.15032 158.3
[M+K]+ 240.07966 150.0
[M+H-H2O]+ 184.11376 135.2
[M+HCOO]- 246.11470 158.1
[M+CH3COO]- 260.13035 182.1
[M+Na-2H]- 222.09117 148.4
[M]+ 201.11595 146.2
[M]- 201.11705 146.2
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.