CID 5223225

Fmoc-1-pyrrolidine-3-carboxylic acid

Structural Information

Molecular Formula
C20H19NO4
SMILES
C1CN(CC1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C20H19NO4/c22-19(23)13-9-10-21(11-13)20(24)25-12-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18H,9-12H2,(H,22,23)
InChIKey
GUAMYYOQAAUXLR-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-ylmethoxycarbonyl)pyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

337.1314 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.13868 178.9
[M+Na]+ 360.12062 189.4
[M+NH4]+ 355.16522 186.2
[M+K]+ 376.09456 187.2
[M-H]- 336.12412 181.0
[M+Na-2H]- 358.10607 182.0
[M]+ 337.13085 180.7
[M]- 337.13195 180.7
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