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Methyl (2R,3aR)-2-[3-(benzyloxy)-1-oxopropyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
SpectraBase Compound ID zXXomxJqy7
InChI InChI=1S/C19H25NO5/c1-23-19(22)18-17(15-9-5-6-11-20(15)25-18)16(21)10-12-24-13-14-7-3-2-4-8-14/h2-4,7-8,15,17-18H,5-6,9-13H2,1H3/t15-,17+,18-/m1/s1
InChIKey ZYAOPBZSHHNXFV-BPQIPLTHSA-N
Mol Weight 347.41 g/mol
Molecular Formula C19H25NO5
Exact Mass 347.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20Vts4UtjlW
Name Methyl (2R,3aR)-2-[3-(benzyloxy)-1-oxopropyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
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Formula C19H25NO5
InChI InChI=1S/C19H25NO5/c1-23-19(22)18-17(15-9-5-6-11-20(15)25-18)16(21)10-12-24-13-14-7-3-2-4-8-14/h2-4,7-8,15,17-18H,5-6,9-13H2,1H3/t15-,17+,18-/m1/s1
InChIKey ZYAOPBZSHHNXFV-BPQIPLTHSA-N
Molecular Weight 347.411 g/mol
SMILES [C@]1([C@@]([C@]2(CCCCN2O1)[H])(C(=O)CCOCc1ccccc1)[H])(C(=O)OC)[H]
SPLASH splash10-0006-9300000000-37eb1cd2b1261b19057c
Source of Spectrum F-54-10868-15
Synonyms (2R,3R,3aR)-3-(1-oxo-3-phenylmethoxypropyl)-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylic acid methyl ester (2R,3R,3aR)-3-(3-Benzyloxy-propionyl)-hexahydro-isoxazolo[2,3-a]pyridine-2-carboxylic acid methyl ester (2R,3R,3aR)-3-(3-benzoxypropanoyl)-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylic acid methyl ester Methyl (2R,3aR)-2-[3-(benzyloxy)propanoyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate Methyl (2RS,3RS,3aSR)-2-[3-(benzyloxy)-1-oxopropyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate Methyl (2R,3R,3aR)-3-(3-benzyloxypropanoyl)-3,3a,4,5,6,7-hexahydro-2H-isoxazolo[2,3-a]pyridine-2-carboxylate Methyl (2RS,3RS,3aSR)-2-[3-(benzyloxy)-1-oxopropyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate Methyl (2R,3R,3aR)-3-(3-phenylmethoxypropanoyl)-3,3a,4,5,6,7-hexahydro-2H-[1,2]oxazolo[2,3-a]pyridine-2-carboxylate
Wiley ID 808589