![(5R,8aS,8bS)-2-keto-5-methoxy-5,6,7,8,8a,8b-hexahydro-1H-azet[1,2-b]isoindole-4-carboxylic acid methyl ester](/api/spectrum/69NeHYvXEOW/structure.png?h=300&w=458 "(5R,8aS,8bS)-2-keto-5-methoxy-5,6,7,8,8a,8b-hexahydro-1H-azet[1,2-b]isoindole-4-carboxylic acid methyl ester")
| SpectraBase Compound ID | 8Q6kVAdJ4uD |
|---|---|
| InChI | InChI=1S/C13H17NO4/c1-17-9-5-3-4-7-8-6-10(15)14(8)12(11(7)9)13(16)18-2/h7-9H,3-6H2,1-2H3/t7-,8-,9-/m0/s1 |
| InChIKey | OLDUPDVYSCAYOU-CIUDSAMLSA-N |
| Mol Weight | 251.28 g/mol |
| Molecular Formula | C13H17NO4 |
| Exact Mass | 251.115758 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 69NeHYvXEOW |
|---|---|
| Name | (5R,8aS,8bS)-2-keto-5-methoxy-5,6,7,8,8a,8b-hexahydro-1H-azet[1,2-b]isoindole-4-carboxylic acid methyl ester |
| Alternate Name(s) | (5R,8aS,8bS)-5-methoxy-2-oxo-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylic acid methyl ester Methyl (5R,8aS,8bS)-5-methoxy-2-oxidanylidene-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylate Methyl (5R,8aS,8bS)-5-methoxy-2-oxo-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylate (5S,8aR,8bS)-5-methoxy-2-oxo-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylic acid methyl ester Methyl (5S,8aR,8bS)-5-methoxy-2-oxo-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylate Methyl (5S,8aR,8bS)-5-methoxy-2-oxidanylidene-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17NO4 |
| InChI | InChI=1S/C13H17NO4/c1-17-9-5-3-4-7-8-6-10(15)14(8)12(11(7)9)13(16)18-2/h7-9H,3-6H2,1-2H3/t7-,8-,9-/m0/s1 |
| InChIKey | OLDUPDVYSCAYOU-CIUDSAMLSA-N |
| Molecular Weight | 251.282 g/mol |
| SMILES | C=1(N2[C@]([C@@]3(CCC[C@@](C13)(OC)[H])[H])(CC2=O)[H])C(=O)OC |
| SPLASH | splash10-0uy0-6930000000-377ba8d0b3516d178141 |
| Source of Spectrum | KC-0-2034-25 |
| Wiley ID | 786193 |