CID 45076246

2-(1-((((9h-fluoren-9-yl)methoxy)carbonyl)amino)cyclopentyl)acetic acid

Structural Information

Molecular Formula
C22H23NO4
SMILES
C1CCC(C1)(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C22H23NO4/c24-20(25)13-22(11-5-6-12-22)23-21(26)27-14-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19/h1-4,7-10,19H,5-6,11-14H2,(H,23,26)(H,24,25)
InChIKey
ZPLSFORKBASRNA-UHFFFAOYSA-N
Compound name
2-[1-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopentyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

365.16272 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.17000 187.6
[M+Na]+ 388.15194 192.1
[M-H]- 364.15544 194.3
[M+NH4]+ 383.19654 205.9
[M+K]+ 404.12588 187.5
[M+H-H2O]+ 348.15998 181.0
[M+HCOO]- 410.16092 206.0
[M+CH3COO]- 424.17657 213.5
[M+Na-2H]- 386.13739 187.9
[M]+ 365.16217 187.2
[M]- 365.16327 187.2
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