| SpectraBase Compound ID | 4A8zQvOhPcn |
|---|---|
| InChI | InChI=1S/C7H10O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h1,4,6-9,11-12H,2H2/t4-,6?,7?/m1/s1 |
| InChIKey | DEJZWTDEKQRWLD-SIZQZZMJSA-N |
| Mol Weight | 174.15 g/mol |
| Molecular Formula | C7H10O5 |
| Exact Mass | 174.052823 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Cakagb5MUby |
|---|---|
| Name | Gabosine C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O5 |
| InChI | InChI=1S/C7H10O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h1,4,6-9,11-12H,2H2/t4-,6?,7?/m1/s1 |
| InChIKey | DEJZWTDEKQRWLD-SIZQZZMJSA-N |
| Molecular Weight | 174.152 g/mol |
| SMILES | OC1C([C@@](C=C(C1=O)CO)(O)[H])O |
| SPLASH | splash10-02ta-9800000000-99b8b67fb6816c78de74 |
| Source of Spectrum | U-1993-247-3 |
| Wiley ID | 764708 |