CID 136239864

6-bromo-4-hydroxy-2-oxo-2h-chromene-3-carbaldehyde

Structural Information

Molecular Formula
C10H5BrO4
SMILES
C1=CC2=C(C=C1Br)C(=C(C(=O)O2)C=O)O
InChI
InChI=1S/C10H5BrO4/c11-5-1-2-8-6(3-5)9(13)7(4-12)10(14)15-8/h1-4,13H
InChIKey
QDZUGVPQHMKMBU-UHFFFAOYSA-N
Compound name
6-bromo-4-hydroxy-2-oxochromene-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

267.93713 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.94441 143.0
[M+Na]+ 290.92635 148.4
[M+NH4]+ 285.97095 147.4
[M+K]+ 306.90029 149.0
[M-H]- 266.92985 144.4
[M+Na-2H]- 288.91180 145.9
[M]+ 267.93658 143.0
[M]- 267.93768 143.0
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

patents stripe