CID 10899435

7-hydroxy-2-oxo-2h-chromene-8-carbaldehyde

Structural Information

Molecular Formula
C10H6O4
SMILES
C1=CC(=C(C2=C1C=CC(=O)O2)C=O)O
InChI
InChI=1S/C10H6O4/c11-5-7-8(12)3-1-6-2-4-9(13)14-10(6)7/h1-5,12H
InChIKey
KRBBYDYXQBJMCQ-UHFFFAOYSA-N
Compound name
7-hydroxy-2-oxochromene-8-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

25
Patents

190.02661 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.03389 133.9
[M+Na]+ 213.01583 148.9
[M+NH4]+ 208.06043 142.1
[M+K]+ 228.98977 143.2
[M-H]- 189.01933 137.0
[M+Na-2H]- 211.00128 140.3
[M]+ 190.02606 136.9
[M]- 190.02716 136.9
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

patents stripe