CID 5355213

5-hydroxy-4,7-dimethyl-2h-chromen-2-one

Structural Information

Molecular Formula
C11H10O3
SMILES
CC1=CC(=C2C(=CC(=O)OC2=C1)C)O
InChI
InChI=1S/C11H10O3/c1-6-3-8(12)11-7(2)5-10(13)14-9(11)4-6/h3-5,12H,1-2H3
InChIKey
JJHLYYXMYNBADE-UHFFFAOYSA-N
Compound name
5-hydroxy-4,7-dimethylchromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

190.06299 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.07027 135.0
[M+Na]+ 213.05221 146.7
[M-H]- 189.05571 140.5
[M+NH4]+ 208.09681 154.8
[M+K]+ 229.02615 144.8
[M+H-H2O]+ 173.06025 129.8
[M+HCOO]- 235.06119 157.3
[M+CH3COO]- 249.07684 182.3
[M+Na-2H]- 211.03766 143.2
[M]+ 190.06244 138.6
[M]- 190.06354 138.6
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