CID 132350906

2137143-57-6

Structural Information

Molecular Formula
C20H19NO5
SMILES
C1C(CC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O
InChI
InChI=1S/C20H19NO5/c22-12-9-20(10-12,18(23)24)21-19(25)26-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,12,17,22H,9-11H2,(H,21,25)(H,23,24)
InChIKey
BJIOQZLQMVAEFZ-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxycyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.1263 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.13358 182.4
[M+Na]+ 376.11552 186.4
[M-H]- 352.11902 187.8
[M+NH4]+ 371.16012 192.3
[M+K]+ 392.08946 185.9
[M+H-H2O]+ 336.12356 170.6
[M+HCOO]- 398.12450 198.6
[M+CH3COO]- 412.14015 213.0
[M+Na-2H]- 374.10097 184.2
[M]+ 353.12575 191.4
[M]- 353.12685 191.4
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.