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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)

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
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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