![Methyl (2S,3S,3aS,16S)-2-(3-Hydroxyprop-1-yl)-6-pivaloyloxymethylhexahydropyrrolo[1,2-b]isoxazol-3-carboxylate](/api/spectrum/DEODX73Q2D/structure.png?h=300&w=458 "Methyl (2S,3S,3aS,16S)-2-(3-Hydroxyprop-1-yl)-6-pivaloyloxymethylhexahydropyrrolo[1,2-b]isoxazol-3-carboxylate")
| SpectraBase Compound ID | IdRHUp2lbES |
|---|---|
| InChI | InChI=1S/C17H29NO6/c1-17(2,3)16(21)23-10-11-7-8-12-14(15(20)22-4)13(6-5-9-19)24-18(11)12/h11-14,19H,5-10H2,1-4H3/t11-,12-,13-,14-/m0/s1 |
| InChIKey | WGXXLFFIOPDFNV-XUXIUFHCSA-N |
| Mol Weight | 343.42 g/mol |
| Molecular Formula | C17H29NO6 |
| Exact Mass | 343.199488 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DEODX73Q2D |
|---|---|
| Name | Methyl (2S,3S,3aS,16S)-2-(3-Hydroxyprop-1-yl)-6-pivaloyloxymethylhexahydropyrrolo[1,2-b]isoxazol-3-carboxylate |
| Alternate Name(s) | (2S,3S,3aS,6S)-6-[(2,2-dimethyl-1-oxopropoxy)methyl]-2-(3-hydroxypropyl)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b]isoxazole-3-carboxylic acid methyl ester Methyl (2S,3S,3aS,6S)-6-(2,2-dimethylpropanoyloxymethyl)-2-(3-hydroxypropyl)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b][1,2]oxazole-3-carboxylate Methyl (2S,3S,3aS,6S)-6-(2,2-dimethylpropanoyloxymethyl)-2-(3-hydroxypropyl)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b]isoxazole-3-carboxylate Methyl (2S,3S,3aS,6S)-6-(2,2-dimethylpropanoyloxymethyl)-2-(3-oxidanylpropyl)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b][1,2]oxazole-3-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H29NO6 |
| InChI | InChI=1S/C17H29NO6/c1-17(2,3)16(21)23-10-11-7-8-12-14(15(20)22-4)13(6-5-9-19)24-18(11)12/h11-14,19H,5-10H2,1-4H3/t11-,12-,13-,14-/m0/s1 |
| InChIKey | WGXXLFFIOPDFNV-XUXIUFHCSA-N |
| Molecular Weight | 343.420 g/mol |
| SMILES | OCCC[C@@]1(ON2[C@]([C@@]1(C(=O)OC)[H])(CC[C@]2(COC(C(C)(C)C)=O)[H])[H])[H] |
| SPLASH | splash10-0bvi-6191000000-e5c42b3f354143f05b96 |
| Source of Spectrum | F-70-3164-18 |
| Wiley ID | 1596669 |