| SpectraBase Compound ID | 36oivh5VTK8 |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-5(8)6(9)3-4-7(10)11-2/h3-6,8-9H,1-2H3/b4-3+ |
| InChIKey | JEDCCDABYXNUDA-ONEGZZNKSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LvpbnkxabuM |
|---|---|
| Name | Methyl 4,5-dihydroxy-2-hexenoate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-5(8)6(9)3-4-7(10)11-2/h3-6,8-9H,1-2H3/b4-3+ |
| InChIKey | JEDCCDABYXNUDA-ONEGZZNKSA-N |
| Molecular Weight | 160.169 g/mol |
| SMILES | OC(C(\C=C\C(=O)OC)O)C |
| SPLASH | splash10-05o1-9200000000-019114b06be3c10367f0 |
| Source of Spectrum | Y4-86-667-9 |
| Synonyms | Methyl (2E)-4,5-dihydroxy-2-hexenoate |
| Wiley ID | 1550248 |