CID 5072296

200348-34-1

Structural Information

Molecular Formula
C19H12O3
SMILES
COC(=O)C1=CC2=CC=CC=C2C3=C1C(=O)C4=CC=CC=C43
InChI
InChI=1S/C19H12O3/c1-22-19(21)15-10-11-6-2-3-7-12(11)16-13-8-4-5-9-14(13)18(20)17(15)16/h2-10H,1H3
InChIKey
MHJUEFNBCMYNDN-UHFFFAOYSA-N
Compound name
methyl 7-oxobenzo[c]fluorene-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.07864 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.085916 164.1
[M+Na]+ 311.067858 174.7
[M-H]- 287.071364 171.3
[M+NH4]+ 306.112463 184.8
[M+K]+ 327.041798 169.5
[M+H-H2O]+ 271.075900 157.5
[M+HCOO]- 333.076841 185.2
[M+CH3COO]- 347.092491 177.2
[M+Na-2H]- 309.053306 169.3
[M]+ 288.07809142 168.1
[M]- 288.07918858 168.1
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.