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(1S,4S,5R,7R)-3-benzyl-2-keto-4-methyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
SpectraBase Compound ID Ewg28hHtoVo
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+/m0/s1
InChIKey PHTDIXMWAFJWEX-APAOZMKASA-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 15qWIu30bi6
Name (1S,4S,5R,7R)-3-benzyl-2-keto-4-methyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
Alternate Name(s) (1S,4S,5R,7R)-4-methyl-2-oxo-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester methyl (1S,4S,5R,7R)-3-benzyl-4-methyl-2-oxo-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate methyl (1S,4S,5R,7R)-4-methyl-2-oxidanylidene-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate
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+/m0/s1
InChIKey PHTDIXMWAFJWEX-APAOZMKASA-N
Molecular Weight 291.303 g/mol
SMILES [C@@]12(C(N(Cc3ccccc3)[C@]([C@@](O1)([H])O[C@]2(C(=O)OC)[H])(C)[H])=O)[H]
SPLASH splash10-0006-9000000000-eee3e619dcf230b54a04
Source of Spectrum J-64-7360-12
Wiley ID 1531116