CID 2756173

147900-45-6

Structural Information

Molecular Formula
C22H23NO4
SMILES
C1CC(CCC1C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C22H23NO4/c24-21(25)14-9-11-15(12-10-14)23-22(26)27-13-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,14-15,20H,9-13H2,(H,23,26)(H,24,25)
InChIKey
RIZQTCLNVHZQOO-UHFFFAOYSA-N
Compound name
4-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

365.16272 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.169996 184.7
[M+Na]+ 388.151938 188.1
[M-H]- 364.155444 190.6
[M+NH4]+ 383.196543 199.1
[M+K]+ 404.125878 183.5
[M+H-H2O]+ 348.159980 176.9
[M+HCOO]- 410.160921 200.7
[M+CH3COO]- 424.176571 215.8
[M+Na-2H]- 386.137386 185.0
[M]+ 365.16217142 182.0
[M]- 365.16326858 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

patents stripe