CID 17750446

160977-92-4

Structural Information

Molecular Formula
C23H19NO4
SMILES
CN(C1=CC=C(C=C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C23H19NO4/c1-24(16-12-10-15(11-13-16)22(25)26)23(27)28-14-21-19-8-4-2-6-17(19)18-7-3-5-9-20(18)21/h2-13,21H,14H2,1H3,(H,25,26)
InChIKey
HQOGMQFPENTFMI-UHFFFAOYSA-N
Compound name
4-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

373.1314 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.13868 187.7
[M+Na]+ 396.12062 200.5
[M+NH4]+ 391.16522 195.4
[M+K]+ 412.09456 195.4
[M-H]- 372.12412 192.3
[M+Na-2H]- 394.10607 194.0
[M]+ 373.13085 190.8
[M]- 373.13195 190.8
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