CID 50536
Potassium 2-(4-hydroxyphenyl)-2-((4-methoxy-4-oxobut-2-en-2-yl)amino)acetate
Structural Information
- Molecular Formula
- C13H15NO5
- SMILES
- CC(=CC(=O)OC)NC(C1=CC=C(C=C1)O)C(=O)O
- InChI
- InChI=1S/C13H15NO5/c1-8(7-11(16)19-2)14-12(13(17)18)9-3-5-10(15)6-4-9/h3-7,12,14-15H,1-2H3,(H,17,18)
- InChIKey
- VXLHFWHJVCLKPT-UHFFFAOYSA-N
- Compound name
- 2-(4-hydroxyphenyl)-2-[(4-methoxy-4-oxobut-2-en-2-yl)amino]acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 266.10231 | 159.2 |
[M+Na]+ | 288.08425 | 163.6 |
[M-H]- | 264.08775 | 159.8 |
[M+NH4]+ | 283.12885 | 173.5 |
[M+K]+ | 304.05819 | 162.1 |
[M+H-H2O]+ | 248.09229 | 152.7 |
[M+HCOO]- | 310.09323 | 178.1 |
[M+CH3COO]- | 324.10888 | 194.7 |
[M+Na-2H]- | 286.06970 | 159.0 |
[M]+ | 265.09448 | 158.7 |
[M]- | 265.09558 | 158.7 |
Literature stripe
No literature data available for this compound.