CID 104106
2-(4-acetylphenoxy)-2-methylpropanoic acid
Structural Information
- Molecular Formula
- C12H14O4
- SMILES
- CC(=O)C1=CC=C(C=C1)OC(C)(C)C(=O)O
- InChI
- InChI=1S/C12H14O4/c1-8(13)9-4-6-10(7-5-9)16-12(2,3)11(14)15/h4-7H,1-3H3,(H,14,15)
- InChIKey
- CDUYSGJRDZEJPK-UHFFFAOYSA-N
- Compound name
- 2-(4-acetylphenoxy)-2-methylpropanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 223.09648 | 148.0 |
[M+Na]+ | 245.07842 | 158.4 |
[M+NH4]+ | 240.12302 | 154.1 |
[M+K]+ | 261.05236 | 155.1 |
[M-H]- | 221.08192 | 147.3 |
[M+Na-2H]- | 243.06387 | 152.4 |
[M]+ | 222.08865 | 149.1 |
[M]- | 222.08975 | 149.1 |
Literature stripe
No literature data available for this compound.