CID 132349255

2138266-64-3

Structural Information

Molecular Formula
C20H19NO5
SMILES
C1CO[C@H]([C@H]1NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
InChI
InChI=1S/C20H19NO5/c22-19(23)18-17(9-10-25-18)21-20(24)26-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-18H,9-11H2,(H,21,24)(H,22,23)/t17-,18+/m0/s1
InChIKey
NUCSYZBFEPVWSU-ZWKOTPCHSA-N
Compound name
(2R,3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)oxolane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.1263 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.133576 180.0
[M+Na]+ 376.115518 185.1
[M-H]- 352.119024 187.8
[M+NH4]+ 371.160123 195.7
[M+K]+ 392.089458 182.7
[M+H-H2O]+ 336.123560 174.0
[M+HCOO]- 398.124501 198.4
[M+CH3COO]- 412.140151 211.9
[M+Na-2H]- 374.100966 180.5
[M]+ 353.12575142 181.2
[M]- 353.12684858 181.2
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

No patent data available for this compound.