CID 707698

5-ethyl-2,3-dimethyl-7h-furo[3,2-g]chromen-7-one

Structural Information

Molecular Formula
C15H14O3
SMILES
CCC1=CC(=O)OC2=C1C=C3C(=C(OC3=C2)C)C
InChI
InChI=1S/C15H14O3/c1-4-10-5-15(16)18-14-7-13-11(6-12(10)14)8(2)9(3)17-13/h5-7H,4H2,1-3H3
InChIKey
GARBLMXFSNEPTJ-UHFFFAOYSA-N
Compound name
5-ethyl-2,3-dimethylfuro[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

242.0943 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.101576 150.5
[M+Na]+ 265.083518 164.2
[M-H]- 241.087024 159.3
[M+NH4]+ 260.128123 170.7
[M+K]+ 281.057458 162.4
[M+H-H2O]+ 225.091560 145.5
[M+HCOO]- 287.092501 173.9
[M+CH3COO]- 301.108151 166.2
[M+Na-2H]- 263.068966 158.1
[M]+ 242.09375142 159.2
[M]- 242.09484858 159.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.