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(2S,3S,3aR)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(2S,3S,3aR)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylic acid methyl ester
SpectraBase Compound ID 1GHUMRC0mdZ
InChI InChI=1S/C14H23NO5/c1-14(2)18-8-10(19-14)12-11(13(16)17-3)9-6-4-5-7-15(9)20-12/h9-12H,4-8H2,1-3H3/t9-,10-,11+,12-/m1/s1
InChIKey YTEMNMSMSHMSRJ-WISYIIOYSA-N
Mol Weight 285.34 g/mol
Molecular Formula C14H23NO5
Exact Mass 285.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ao8VyoybkS
Name (2S,3S,3aR)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO5
InChI InChI=1S/C14H23NO5/c1-14(2)18-8-10(19-14)12-11(13(16)17-3)9-6-4-5-7-15(9)20-12/h9-12H,4-8H2,1-3H3/t9-,10-,11+,12-/m1/s1
InChIKey YTEMNMSMSHMSRJ-WISYIIOYSA-N
Molecular Weight 285.340 g/mol
SMILES [C@@]1([C@]([C@]2(CCCCN2O1)[H])(C(=O)OC)[H])([C@@]1(OC(C)(C)OC1)[H])[H]
SPLASH splash10-0f8a-9420000000-72dbbb8ec92731d7c823
Source of Spectrum J-61-8583-17
Synonyms Methyl (2S,3S,3aR)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate Methyl (2S,3S,3aR)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3a,4,5,6,7-hexahydro-2H-[1,2]oxazolo[2,3-a]pyridine-3-carboxylate
Wiley ID 1288838