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(2'R,5RS)-5-Butyl-3-([2'-(methoxycarbonyl)pyrrolidin-1-ylcarbonyl]-4,5-dihydroisoxazole 2-oxide
SpectraBase Compound ID AfNYG156sly
InChI InChI=1S/C14H22N2O5/c1-3-4-6-10-9-12(16(19)21-10)13(17)15-8-5-7-11(15)14(18)20-2/h10-11H,3-9H2,1-2H3/t10?,11-/m0/s1
InChIKey YKAVHFXRVIBJID-DTIOYNMSSA-N
Mol Weight 298.34 g/mol
Molecular Formula C14H22N2O5
Exact Mass 298.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fT4UtuKgK
Name (2'R,5RS)-5-Butyl-3-([2'-(methoxycarbonyl)pyrrolidin-1-ylcarbonyl]-4,5-dihydroisoxazole 2-oxide
Alternate Name(s) (2S)-1-[(5-butyl-2-oxido-4,5-dihydroisoxazol-2-ium-3-yl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester Methyl (2S)-1-(5-butyl-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3-carbonyl)pyrrolidine-2-carboxylate Methyl (2S)-1-(5-butyl-2-oxido-4,5-dihydroisoxazol-2-ium-3-carbonyl)pyrrolidine-2-carboxylate Methyl (2S)-1-[(5-butyl-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium-3-yl)carbonyl]pyrrolidine-2-carboxylate
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Formula C14H22N2O5
InChI InChI=1S/C14H22N2O5/c1-3-4-6-10-9-12(16(19)21-10)13(17)15-8-5-7-11(15)14(18)20-2/h10-11H,3-9H2,1-2H3/t10?,11-/m0/s1
InChIKey YKAVHFXRVIBJID-DTIOYNMSSA-N
Molecular Weight 298.339 g/mol
SMILES C1(=[N+](OC(C1)CCCC)[O-])C(N1[C@](C(=O)OC)(CCC1)[H])=O
SPLASH splash10-00fr-6940000000-b7cb2e10c021681a79cc
Source of Spectrum KC-0-2036-14
Wiley ID 781636