CID 73994693

Methyl 3-fluoropyrrolidine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C6H10FNO2
SMILES
COC(=O)C1(CCNC1)F
InChI
InChI=1S/C6H10FNO2/c1-10-5(9)6(7)2-3-8-4-6/h8H,2-4H2,1H3
InChIKey
VQPLTCRXZJGCLO-UHFFFAOYSA-N
Compound name
methyl 3-fluoropyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

147.06955 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.07683 128.8
[M+Na]+ 170.05877 135.9
[M-H]- 146.06227 128.2
[M+NH4]+ 165.10337 151.6
[M+K]+ 186.03271 135.1
[M+H-H2O]+ 130.06681 123.1
[M+HCOO]- 192.06775 148.0
[M+CH3COO]- 206.08340 168.6
[M+Na-2H]- 168.04422 133.2
[M]+ 147.06900 124.7
[M]- 147.07010 124.7
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

patents stripe