CID 103439537

1702888-95-6

Structural Information

Molecular Formula
C20H19NO4
SMILES
CN(C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C4(CC4)C(=O)O
InChI
InChI=1S/C20H19NO4/c1-21(20(10-11-20)18(22)23)19(24)25-12-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-12H2,1H3,(H,22,23)
InChIKey
PCEPBBOZZJAHST-UHFFFAOYSA-N
Compound name
1-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.1314 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.13868 176.2
[M+Na]+ 360.12062 184.3
[M-H]- 336.12412 184.9
[M+NH4]+ 355.16522 190.0
[M+K]+ 376.09456 180.7
[M+H-H2O]+ 320.12866 170.3
[M+HCOO]- 382.12960 196.1
[M+CH3COO]- 396.14525 214.5
[M+Na-2H]- 358.10607 179.4
[M]+ 337.13085 182.0
[M]- 337.13195 182.0
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.