CID 119032134

Ethyl 8-fluoro-2-oxa-6-azaspiro[3.4]octane-8-carboxylate

Structural Information

Molecular Formula
C9H14FNO3
SMILES
CCOC(=O)C1(CNCC12COC2)F
InChI
InChI=1S/C9H14FNO3/c1-2-14-7(12)9(10)4-11-3-8(9)5-13-6-8/h11H,2-6H2,1H3
InChIKey
MHZSLMPGYBWUSE-UHFFFAOYSA-N
Compound name
ethyl 5-fluoro-2-oxa-7-azaspiro[3.4]octane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.09576 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.10304 140.2
[M+Na]+ 226.08498 145.6
[M-H]- 202.08848 142.5
[M+NH4]+ 221.12958 155.2
[M+K]+ 242.05892 148.1
[M+H-H2O]+ 186.09302 130.8
[M+HCOO]- 248.09396 156.0
[M+CH3COO]- 262.10961 181.5
[M+Na-2H]- 224.07043 145.3
[M]+ 203.09521 146.2
[M]- 203.09631 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.