CID 3055698
2h-1-benzopyran-6-acetic acid, 3,4-dihydro-4-oxo-
Structural Information
- Molecular Formula
- C11H10O4
- SMILES
- C1COC2=C(C1=O)C=C(C=C2)CC(=O)O
- InChI
- InChI=1S/C11H10O4/c12-9-3-4-15-10-2-1-7(5-8(9)10)6-11(13)14/h1-2,5H,3-4,6H2,(H,13,14)
- InChIKey
- WCSYPSLAPJKCFG-UHFFFAOYSA-N
- Compound name
- 2-(4-oxo-2,3-dihydrochromen-6-yl)acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 207.06518 | 141.2 |
[M+Na]+ | 229.04712 | 153.4 |
[M+NH4]+ | 224.09172 | 149.0 |
[M+K]+ | 245.02106 | 148.5 |
[M-H]- | 205.05062 | 143.6 |
[M+Na-2H]- | 227.03257 | 145.4 |
[M]+ | 206.05735 | 143.5 |
[M]- | 206.05845 | 143.5 |
Literature stripe
No literature data available for this compound.