CID 146155486

2416230-86-7

Structural Information

Molecular Formula
C22H23NO5
SMILES
CC1(C(CC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O)C
InChI
InChI=1S/C22H23NO5/c1-21(2)18(24)11-22(21,19(25)26)23-20(27)28-12-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,17-18,24H,11-12H2,1-2H3,(H,23,27)(H,25,26)
InChIKey
NCLUSSBPTQZDGE-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-2,2-dimethylcyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.15762 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.16490 192.7
[M+Na]+ 404.14684 197.7
[M+NH4]+ 399.19144 197.4
[M+K]+ 420.12078 192.4
[M-H]- 380.15034 191.7
[M+Na-2H]- 402.13229 194.9
[M]+ 381.15707 191.9
[M]- 381.15817 191.9
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.