CID 16227066
7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid
Structural Information
- Molecular Formula
- C11H12O4
- SMILES
- CC1CC2=C(O1)C(=CC(=C2)C(=O)O)OC
- InChI
- InChI=1S/C11H12O4/c1-6-3-7-4-8(11(12)13)5-9(14-2)10(7)15-6/h4-6H,3H2,1-2H3,(H,12,13)
- InChIKey
- FNGZHLBOFSICNM-UHFFFAOYSA-N
- Compound name
- 7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 209.08084 | 141.8 |
[M+Na]+ | 231.06278 | 150.9 |
[M-H]- | 207.06628 | 146.3 |
[M+NH4]+ | 226.10738 | 162.1 |
[M+K]+ | 247.03672 | 150.1 |
[M+H-H2O]+ | 191.07082 | 137.2 |
[M+HCOO]- | 253.07176 | 162.5 |
[M+CH3COO]- | 267.08741 | 184.3 |
[M+Na-2H]- | 229.04823 | 146.1 |
[M]+ | 208.07301 | 145.0 |
[M]- | 208.07411 | 145.0 |