CID 21515515
55703-81-6
Structural Information
- Molecular Formula
- C12H16O4
- SMILES
- CC(C)C1=C(C=C(C=C1OC)C(=O)O)OC
- InChI
- InChI=1S/C12H16O4/c1-7(2)11-9(15-3)5-8(12(13)14)6-10(11)16-4/h5-7H,1-4H3,(H,13,14)
- InChIKey
- XMENJIQNZZREBQ-UHFFFAOYSA-N
- Compound name
- 3,5-dimethoxy-4-propan-2-ylbenzoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 225.11214 | 148.8 |
[M+Na]+ | 247.09408 | 160.3 |
[M+NH4]+ | 242.13868 | 155.4 |
[M+K]+ | 263.06802 | 156.1 |
[M-H]- | 223.09758 | 149.1 |
[M+Na-2H]- | 245.07953 | 152.9 |
[M]+ | 224.10431 | 150.3 |
[M]- | 224.10541 | 150.3 |
Literature stripe
No literature data available for this compound.