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Methyl (1R,4S,5S,7R)-3-(p-Methoxybenzyl)-2-oxo-4-exo-benzyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-exo-carboxylate
SpectraBase Compound ID CLpAVcuKsfH
InChI InChI=1S/C22H23NO6/c1-26-16-10-8-15(9-11-16)13-23-17(12-14-6-4-3-5-7-14)22-28-18(20(23)24)19(29-22)21(25)27-2/h3-11,17-19,22H,12-13H2,1-2H3/t17-,18+,19+,22-/m0/s1
InChIKey RIYNKACKWRRHHU-JYLXEMOASA-N
Mol Weight 397.43 g/mol
Molecular Formula C22H23NO6
Exact Mass 397.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2m5PjV0pYq9
Name Methyl (1R,4S,5S,7R)-3-(p-Methoxybenzyl)-2-oxo-4-exo-benzyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-exo-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C22H23NO6
InChI InChI=1S/C22H23NO6/c1-26-16-10-8-15(9-11-16)13-23-17(12-14-6-4-3-5-7-14)22-28-18(20(23)24)19(29-22)21(25)27-2/h3-11,17-19,22H,12-13H2,1-2H3/t17-,18+,19+,22-/m0/s1
InChIKey RIYNKACKWRRHHU-JYLXEMOASA-N
Molecular Weight 397.427 g/mol
SMILES [C@]12(C(N([C@]([C@](O[C@]2(C(=O)OC)[H])(O1)[H])(Cc1ccccc1)[H])Cc1ccc(cc1)OC)=O)[H]
SPLASH splash10-00di-0901000000-f59f46dfd4a38b2d9058
Source of Spectrum J-64-7359-3
Synonyms methyl (1R,4S,5S,7R)-4-benzyl-3-(4-methoxybenzyl)-2-oxo-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate
Wiley ID 1531123