CID 3078951

Acetic acid, 2,2'-((9-oxo-9h-fluorene-2,7-diyl)bis(oxy))bis-, dimethyl ester

Structural Information

Molecular Formula
C19H16O7
SMILES
COC(=O)COC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)OCC(=O)OC
InChI
InChI=1S/C19H16O7/c1-23-17(20)9-25-11-3-5-13-14-6-4-12(26-10-18(21)24-2)8-16(14)19(22)15(13)7-11/h3-8H,9-10H2,1-2H3
InChIKey
OBVJUCWEFZAXKP-UHFFFAOYSA-N
Compound name
methyl 2-[7-(2-methoxy-2-oxoethoxy)-9-oxofluoren-2-yl]oxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.0896 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.09688 178.3
[M+Na]+ 379.07882 186.7
[M-H]- 355.08232 184.1
[M+NH4]+ 374.12342 194.9
[M+K]+ 395.05276 185.1
[M+H-H2O]+ 339.08686 171.6
[M+HCOO]- 401.08780 199.5
[M+CH3COO]- 415.10345 213.8
[M+Na-2H]- 377.06427 180.5
[M]+ 356.08905 188.0
[M]- 356.09015 188.0
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.