CID 154577275

2418707-53-4

Structural Information

Molecular Formula
C8H14FNO2
SMILES
COC(=O)C1(CCNC1)CCF
InChI
InChI=1S/C8H14FNO2/c1-12-7(11)8(2-4-9)3-5-10-6-8/h10H,2-6H2,1H3
InChIKey
UNBISBKUFAKAGN-UHFFFAOYSA-N
Compound name
methyl 3-(2-fluoroethyl)pyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.10086 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.10814 138.0
[M+Na]+ 198.09008 144.1
[M-H]- 174.09358 137.0
[M+NH4]+ 193.13468 159.6
[M+K]+ 214.06402 142.9
[M+H-H2O]+ 158.09812 131.8
[M+HCOO]- 220.09906 156.4
[M+CH3COO]- 234.11471 174.7
[M+Na-2H]- 196.07553 141.2
[M]+ 175.10031 134.5
[M]- 175.10141 134.5
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.