![Methyl (2RS,3RS,3aRS)-2-acetylhexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate](/api/spectrum/BpLPAOp84O3/structure.png?h=300&w=458 "Methyl (2RS,3RS,3aRS)-2-acetylhexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate")
| SpectraBase Compound ID | 4FSHF2735Rn |
|---|---|
| InChI | InChI=1S/C11H17NO4/c1-7(13)9-8-5-3-4-6-12(8)16-10(9)11(14)15-2/h8-10H,3-6H2,1-2H3/t8-,9-,10-/m1/s1 |
| InChIKey | OTNFZCVVMPFRCD-OPRDCNLKSA-N |
| Mol Weight | 227.26 g/mol |
| Molecular Formula | C11H17NO4 |
| Exact Mass | 227.115758 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BpLPAOp84O3 |
|---|---|
| Name | Methyl (2RS,3RS,3aRS)-2-acetylhexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate |
| Alternate Name(s) | (2R,3R,3aR)-3-Acetyl-hexahydro-isoxazolo[2,3-a]pyridine-2-carboxylic acid methyl ester Methyl 3-acetylhexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate Methyl (2R,3R,3aR)-3-acetyl-3,3a,4,5,6,7-hexahydro-2H-[1,2]oxazolo[2,3-a]pyridine-2-carboxylate Methyl (2R,3R,3aR)-3-acetyl-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate Methyl (2R,3R,3aR)-3-ethanoyl-3,3a,4,5,6,7-hexahydro-2H-[1,2]oxazolo[2,3-a]pyridine-2-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H17NO4 |
| InChI | InChI=1S/C11H17NO4/c1-7(13)9-8-5-3-4-6-12(8)16-10(9)11(14)15-2/h8-10H,3-6H2,1-2H3/t8-,9-,10-/m1/s1 |
| InChIKey | OTNFZCVVMPFRCD-OPRDCNLKSA-N |
| Molecular Weight | 227.260 g/mol |
| SMILES | [C@]1([C@@]([C@]2(CCCCN2O1)[H])(C(=O)C)[H])(C(=O)OC)[H] |
| SPLASH | splash10-0006-9000000000-25e3918643cd4f90c6ce |
| Source of Spectrum | F-54-10867-14 |
| Wiley ID | 808593 |