CID 265719

2,3-diethoxy-3-hydroxy-2-phenyl-2,3-dihydro-4h-chromen-4-one

Structural Information

Molecular Formula
C19H20O5
SMILES
CCOC1(C(C(=O)C2=CC=CC=C2O1)(O)OCC)C3=CC=CC=C3
InChI
InChI=1S/C19H20O5/c1-3-22-18(21)17(20)15-12-8-9-13-16(15)24-19(18,23-4-2)14-10-6-5-7-11-14/h5-13,21H,3-4H2,1-2H3
InChIKey
YEHVIHIHPUTABX-UHFFFAOYSA-N
Compound name
2,3-diethoxy-3-hydroxy-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

328.13107 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.13835 175.2
[M+Na]+ 351.12029 183.4
[M-H]- 327.12379 182.3
[M+NH4]+ 346.16489 192.0
[M+K]+ 367.09423 181.5
[M+H-H2O]+ 311.12833 167.4
[M+HCOO]- 373.12927 193.5
[M+CH3COO]- 387.14492 205.3
[M+Na-2H]- 349.10574 182.5
[M]+ 328.13052 179.2
[M]- 328.13162 179.2
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.