CID 5276283

2,7-dimethoxy-6-methyl-chromen-4-one

Structural Information

Molecular Formula
C12H12O4
SMILES
CC1=CC2=C(C=C1OC)OC(=CC2=O)OC
InChI
InChI=1S/C12H12O4/c1-7-4-8-9(13)5-12(15-3)16-11(8)6-10(7)14-2/h4-6H,1-3H3
InChIKey
USZMJVRALKPJRD-UHFFFAOYSA-N
Compound name
2,7-dimethoxy-6-methylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.07356 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.08084 142.2
[M+Na]+ 243.06278 153.7
[M-H]- 219.06628 148.8
[M+NH4]+ 238.10738 161.4
[M+K]+ 259.03672 153.1
[M+H-H2O]+ 203.07082 136.2
[M+HCOO]- 265.07176 165.9
[M+CH3COO]- 279.08741 190.0
[M+Na-2H]- 241.04823 150.4
[M]+ 220.07301 149.4
[M]- 220.07411 149.4
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

No patent data available for this compound.