CID 11252483

7-hydroxy-4-oxo-4h-chromene-3-carbaldehyde

Structural Information

Molecular Formula
C10H6O4
SMILES
C1=CC2=C(C=C1O)OC=C(C2=O)C=O
InChI
InChI=1S/C10H6O4/c11-4-6-5-14-9-3-7(12)1-2-8(9)10(6)13/h1-5,12H
InChIKey
ZTPHGPLCHXGENO-UHFFFAOYSA-N
Compound name
7-hydroxy-4-oxochromene-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

190.02661 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.03389 132.2
[M+Na]+ 213.01583 143.6
[M-H]- 189.01933 137.4
[M+NH4]+ 208.06043 151.5
[M+K]+ 228.98977 141.8
[M+H-H2O]+ 173.02387 126.8
[M+HCOO]- 235.02481 155.3
[M+CH3COO]- 249.04046 179.4
[M+Na-2H]- 211.00128 141.7
[M]+ 190.02606 135.7
[M]- 190.02716 135.7
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