CID 131081554

2137577-93-4

Structural Information

Molecular Formula
C8H12FNO2
SMILES
C1CC2(C1)CNCC2(C(=O)O)F
InChI
InChI=1S/C8H12FNO2/c9-8(6(11)12)5-10-4-7(8)2-1-3-7/h10H,1-5H2,(H,11,12)
InChIKey
GITCKFHFBDGNIW-UHFFFAOYSA-N
Compound name
8-fluoro-6-azaspiro[3.4]octane-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.0852 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09248 137.5
[M+Na]+ 196.07442 143.0
[M-H]- 172.07792 138.0
[M+NH4]+ 191.11902 154.2
[M+K]+ 212.04836 143.2
[M+H-H2O]+ 156.08246 128.3
[M+HCOO]- 218.08340 152.7
[M+CH3COO]- 232.09905 174.8
[M+Na-2H]- 194.05987 141.3
[M]+ 173.08465 139.4
[M]- 173.08575 139.4
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.