CID 12650294
2-(p-tolyloxy)-5-chlorobenzoic acid
Structural Information
- Molecular Formula
- C14H11ClO3
- SMILES
- CC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)C(=O)O
- InChI
- InChI=1S/C14H11ClO3/c1-9-2-5-11(6-3-9)18-13-7-4-10(15)8-12(13)14(16)17/h2-8H,1H3,(H,16,17)
- InChIKey
- OXKWNJVSWKFCAW-UHFFFAOYSA-N
- Compound name
- 5-chloro-2-(4-methylphenoxy)benzoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 263.04695 | 153.6 |
[M+Na]+ | 285.02889 | 163.3 |
[M-H]- | 261.03239 | 159.7 |
[M+NH4]+ | 280.07349 | 170.8 |
[M+K]+ | 301.00283 | 158.5 |
[M+H-H2O]+ | 245.03693 | 147.7 |
[M+HCOO]- | 307.03787 | 171.9 |
[M+CH3COO]- | 321.05352 | 192.9 |
[M+Na-2H]- | 283.01434 | 157.6 |
[M]+ | 262.03912 | 157.3 |
[M]- | 262.04022 | 157.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.