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]+ 354.133576 182.4
[M+Na]+ 376.115518 186.4
[M-H]- 352.119024 187.8
[M+NH4]+ 371.160123 192.3
[M+K]+ 392.089458 185.9
[M+H-H2O]+ 336.123560 170.6
[M+HCOO]- 398.124501 198.6
[M+CH3COO]- 412.140151 213.0
[M+Na-2H]- 374.100966 184.2
[M]+ 353.12575142 191.4
[M]- 353.12684858 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.