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(1R,4R,5S,7R)-3-benzyl-2-keto-4-methyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
SpectraBase Compound ID F99vEVTp6GA
InChI InChI=1S/C15H17NO5/c1-9-15-20-11(12(21-15)14(18)19-2)13(17)16(9)8-10-6-4-3-5-7-10/h3-7,9,11-12,15H,8H2,1-2H3/t9-,11-,12-,15+/m1/s1
InChIKey PHTDIXMWAFJWEX-CGEWXTDFSA-N
Mol Weight 291.3 g/mol
Molecular Formula C15H17NO5
Exact Mass 291.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrkPGbzvbU6
Name (1R,4R,5S,7R)-3-benzyl-2-keto-4-methyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C15H17NO5
InChI InChI=1S/C15H17NO5/c1-9-15-20-11(12(21-15)14(18)19-2)13(17)16(9)8-10-6-4-3-5-7-10/h3-7,9,11-12,15H,8H2,1-2H3/t9-,11-,12-,15+/m1/s1
InChIKey PHTDIXMWAFJWEX-CGEWXTDFSA-N
Molecular Weight 291.303 g/mol
SMILES [C@]12(C(N([C@@]([C@](O[C@]2(C(=O)OC)[H])(O1)[H])(C)[H])Cc1ccccc1)=O)[H]
SPLASH splash10-0006-9040000000-c89a2cc875ca392ce61a
Source of Spectrum J-64-7358-7
Synonyms (1R,4R,5S,7R)-4-methyl-2-oxo-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester methyl (1R,4R,5S,7R)-3-benzyl-4-methyl-2-oxo-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate methyl (1R,4R,5S,7R)-4-methyl-2-oxidanylidene-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate
Wiley ID 1531119