CID 33785386
1-(5-methoxy-3-methyl-1-benzofuran-2-yl)ethan-1-one
Structural Information
- Molecular Formula
- C12H12O3
- SMILES
- CC1=C(OC2=C1C=C(C=C2)OC)C(=O)C
- InChI
- InChI=1S/C12H12O3/c1-7-10-6-9(14-3)4-5-11(10)15-12(7)8(2)13/h4-6H,1-3H3
- InChIKey
- HZHJVKJXTREWKL-UHFFFAOYSA-N
- Compound name
- 1-(5-methoxy-3-methyl-1-benzofuran-2-yl)ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 205.08592 | 140.5 |
[M+Na]+ | 227.06786 | 151.8 |
[M-H]- | 203.07136 | 147.1 |
[M+NH4]+ | 222.11246 | 162.0 |
[M+K]+ | 243.04180 | 150.8 |
[M+H-H2O]+ | 187.07590 | 135.6 |
[M+HCOO]- | 249.07684 | 165.1 |
[M+CH3COO]- | 263.09249 | 187.0 |
[M+Na-2H]- | 225.05331 | 146.5 |
[M]+ | 204.07809 | 147.3 |
[M]- | 204.07919 | 147.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.