CID 15284050

909114-68-7

Structural Information

Molecular Formula
C23H19NO4
SMILES
C1=CC=C(C=C1)N(CC(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C23H19NO4/c25-22(26)14-24(16-8-2-1-3-9-16)23(27)28-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21H,14-15H2,(H,25,26)
InChIKey
KLYCHCROKLFIEG-UHFFFAOYSA-N
Compound name
2-[N-(9H-fluoren-9-ylmethoxycarbonyl)anilino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

126
Patents

373.1314 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.13868 187.8
[M+Na]+ 396.12062 192.8
[M-H]- 372.12412 195.9
[M+NH4]+ 391.16522 202.3
[M+K]+ 412.09456 189.0
[M+H-H2O]+ 356.12866 179.2
[M+HCOO]- 418.12960 208.2
[M+CH3COO]- 432.14525 219.5
[M+Na-2H]- 394.10607 190.1
[M]+ 373.13085 190.3
[M]- 373.13195 190.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe