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]+ 338.138676 176.2
[M+Na]+ 360.120618 184.3
[M-H]- 336.124124 184.9
[M+NH4]+ 355.165223 190.0
[M+K]+ 376.094558 180.7
[M+H-H2O]+ 320.128660 170.3
[M+HCOO]- 382.129601 196.1
[M+CH3COO]- 396.145251 214.5
[M+Na-2H]- 358.106066 179.4
[M]+ 337.13085142 182.0
[M]- 337.13194858 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.