![2-[(3R,7aR)-3-tert-butyl-1-keto-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-7a-yl]acetic acid methyl ester](/api/spectrum/1pcuYMuUk3p/structure.png?h=300&w=458 "2-[(3R,7aR)-3-tert-butyl-1-keto-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-7a-yl]acetic acid methyl ester")
| SpectraBase Compound ID | 2kSi9ReUaxc |
|---|---|
| InChI | InChI=1S/C13H21NO4/c1-12(2,3)10-14-7-5-6-13(14,11(16)18-10)8-9(15)17-4/h10H,5-8H2,1-4H3/t10-,13-/m1/s1 |
| InChIKey | MXLVOVSOIYWQOT-ZWNOBZJWSA-N |
| Mol Weight | 255.31 g/mol |
| Molecular Formula | C13H21NO4 |
| Exact Mass | 255.147058 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1pcuYMuUk3p |
|---|---|
| Name | 2-[(3R,7aR)-3-tert-butyl-1-keto-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-7a-yl]acetic acid methyl ester |
| Alternate Name(s) | 2-[(3R,7aR)-3-tert-butyl-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-7a-yl]acetic acid methyl ester Methyl 2-[(3R,7aR)-3-tert-butyl-1-oxidanylidene-3,5,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazol-7a-yl]ethanoate Methyl 2-[(3R,7aR)-3-tert-butyl-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-7a-yl]acetate Methyl 2-[(3R,7aR)-3-tert-butyl-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazol-7a-yl]acetate |
| CAS Registry Number | 86046-15-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21NO4 |
| InChI | InChI=1S/C13H21NO4/c1-12(2,3)10-14-7-5-6-13(14,11(16)18-10)8-9(15)17-4/h10H,5-8H2,1-4H3/t10-,13-/m1/s1 |
| InChIKey | MXLVOVSOIYWQOT-ZWNOBZJWSA-N |
| Molecular Weight | 255.314 g/mol |
| SMILES | [C@@]12(N([C@@](C(C)(C)C)(OC2=O)[H])CCC1)CC(=O)OC |
| SPLASH | splash10-0006-0900000000-35534b574d3ab582277b |
| Source of Spectrum | C-105-5395-0 |
| Wiley ID | 1258749 |