CID 2254592
Ethyl 4,5-dimethyl-2-[(phenoxyacetyl)amino]thiophene-3-carboxylate
Structural Information
- Molecular Formula
- C17H19NO4S
- SMILES
- CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC=CC=C2
- InChI
- InChI=1S/C17H19NO4S/c1-4-21-17(20)15-11(2)12(3)23-16(15)18-14(19)10-22-13-8-6-5-7-9-13/h5-9H,4,10H2,1-3H3,(H,18,19)
- InChIKey
- WJBLDMFEMYVNOM-UHFFFAOYSA-N
- Compound name
- ethyl 4,5-dimethyl-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 334.11078 | 178.6 |
[M+Na]+ | 356.09272 | 185.4 |
[M-H]- | 332.09622 | 185.7 |
[M+NH4]+ | 351.13732 | 194.5 |
[M+K]+ | 372.06666 | 182.2 |
[M+H-H2O]+ | 316.10076 | 171.3 |
[M+HCOO]- | 378.10170 | 197.7 |
[M+CH3COO]- | 392.11735 | 209.9 |
[M+Na-2H]- | 354.07817 | 176.3 |
[M]+ | 333.10295 | 185.2 |
[M]- | 333.10405 | 185.2 |
Literature stripe
No literature data available for this compound.