CID 57366453

1132879-21-0

Structural Information

Molecular Formula
C20H19NO5
SMILES
C1COCC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C20H19NO5/c22-18(23)20(9-10-25-12-20)21-19(24)26-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17H,9-12H2,(H,21,24)(H,22,23)
InChIKey
SRLUOBNBKTVLPZ-UHFFFAOYSA-N
Compound name
3-(9H-fluoren-9-ylmethoxycarbonylamino)oxolane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

353.1263 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.133576 180.6
[M+Na]+ 376.115518 186.1
[M-H]- 352.119024 188.3
[M+NH4]+ 371.160123 198.1
[M+K]+ 392.089458 183.5
[M+H-H2O]+ 336.123560 174.7
[M+HCOO]- 398.124501 199.0
[M+CH3COO]- 412.140151 191.0
[M+Na-2H]- 374.100966 182.9
[M]+ 353.12575142 181.7
[M]- 353.12684858 181.7
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