CID 17955446
Unii-g5dd38seme
Structural Information
- Molecular Formula
- C17H18ClNO4
- SMILES
- COC1=C(C=CC(=C1)CCNC(=O)C(C2=CC=C(C=C2)Cl)O)O
- InChI
- InChI=1S/C17H18ClNO4/c1-23-15-10-11(2-7-14(15)20)8-9-19-17(22)16(21)12-3-5-13(18)6-4-12/h2-7,10,16,20-21H,8-9H2,1H3,(H,19,22)
- InChIKey
- IEKPXXSTLVFKGI-UHFFFAOYSA-N
- Compound name
- 2-(4-chlorophenyl)-2-hydroxy-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 336.09972 | 175.0 |
[M+Na]+ | 358.08166 | 181.6 |
[M-H]- | 334.08516 | 179.2 |
[M+NH4]+ | 353.12626 | 187.9 |
[M+K]+ | 374.05560 | 176.5 |
[M+H-H2O]+ | 318.08970 | 168.3 |
[M+HCOO]- | 380.09064 | 191.0 |
[M+CH3COO]- | 394.10629 | 207.0 |
[M+Na-2H]- | 356.06711 | 176.2 |
[M]+ | 335.09189 | 178.0 |
[M]- | 335.09299 | 178.0 |