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]+ 289.08592 164.1
[M+Na]+ 311.06786 174.7
[M-H]- 287.07136 171.3
[M+NH4]+ 306.11246 184.8
[M+K]+ 327.04180 169.5
[M+H-H2O]+ 271.07590 157.5
[M+HCOO]- 333.07684 185.2
[M+CH3COO]- 347.09249 177.2
[M+Na-2H]- 309.05331 169.3
[M]+ 288.07809 168.1
[M]- 288.07919 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.