CID 2787145

Ethyl 2-(6-oxobenzo[c]chromen-3-yl)oxypropanoate

Structural Information

Molecular Formula
C18H16O5
SMILES
CCOC(=O)C(C)OC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2
InChI
InChI=1S/C18H16O5/c1-3-21-17(19)11(2)22-12-8-9-14-13-6-4-5-7-15(13)18(20)23-16(14)10-12/h4-11H,3H2,1-2H3
InChIKey
BGWRAFUTSSOCHA-UHFFFAOYSA-N
Compound name
ethyl 2-(6-oxobenzo[c]chromen-3-yl)oxypropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.09976 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.10704 167.4
[M+Na]+ 335.08898 183.0
[M+NH4]+ 330.13358 175.1
[M+K]+ 351.06292 176.4
[M-H]- 311.09248 171.3
[M+Na-2H]- 333.07443 173.5
[M]+ 312.09921 170.8
[M]- 312.10031 170.8
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.