CID 146021360

2172469-77-9

Structural Information

Molecular Formula
C20H20N2O4
SMILES
C1C(CN1CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C20H20N2O4/c23-19(24)11-22-9-13(10-22)21-20(25)26-12-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18H,9-12H2,(H,21,25)(H,23,24)
InChIKey
MUFBVKLFEGHAHY-UHFFFAOYSA-N
Compound name
2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)azetidin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.1423 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.14958 181.0
[M+Na]+ 375.13152 184.6
[M-H]- 351.13502 186.1
[M+NH4]+ 370.17612 188.4
[M+K]+ 391.10546 184.0
[M+H-H2O]+ 335.13956 167.3
[M+HCOO]- 397.14050 197.4
[M+CH3COO]- 411.15615 216.0
[M+Na-2H]- 373.11697 182.1
[M]+ 352.14175 190.4
[M]- 352.14285 190.4
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.