CID 6447372
Acetic acid, 2-(3-ethoxyethyl-4-oxo-2-thiazolidinylidene)-, ethyl ester
Structural Information
- Molecular Formula
- C11H17NO4S
- SMILES
- CCOCCN\1C(=O)CS/C1=C/C(=O)OCC
- InChI
- InChI=1S/C11H17NO4S/c1-3-15-6-5-12-9(13)8-17-10(12)7-11(14)16-4-2/h7H,3-6,8H2,1-2H3/b10-7+
- InChIKey
- AIDZNDQLKZXKOS-JXMROGBWSA-N
- Compound name
- ethyl (2E)-2-[3-(2-ethoxyethyl)-4-oxo-1,3-thiazolidin-2-ylidene]acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 260.09511 | 159.1 |
[M+Na]+ | 282.07705 | 165.8 |
[M-H]- | 258.08055 | 161.0 |
[M+NH4]+ | 277.12165 | 177.1 |
[M+K]+ | 298.05099 | 163.9 |
[M+H-H2O]+ | 242.08509 | 152.9 |
[M+HCOO]- | 304.08603 | 174.7 |
[M+CH3COO]- | 318.10168 | 191.9 |
[M+Na-2H]- | 280.06250 | 156.5 |
[M]+ | 259.08728 | 164.0 |
[M]- | 259.08838 | 164.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.