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(1S,3S,4R,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid benzoyl ester
SpectraBase Compound ID 96BKyctVia3
InChI InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(13(18)9-11)16(20)21-15(19)10-5-3-2-4-6-10/h2-6,11-14,18H,7-9H2,1H3/t11-,12+,13+,14-/m1/s1
InChIKey DOMQWRSHTJIAPU-ZOBORPQBSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GszyTS0Kar
Name (1S,3S,4R,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid benzoyl ester
Alternate Name(s) benzoyl (1S,3S,4R,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate phenylcarbonyl (1S,3S,4R,5R)-8-methyl-3-oxidanyl-8-azabicyclo[3.2.1]octane-4-carboxylate
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Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(13(18)9-11)16(20)21-15(19)10-5-3-2-4-6-10/h2-6,11-14,18H,7-9H2,1H3/t11-,12+,13+,14-/m1/s1
InChIKey DOMQWRSHTJIAPU-ZOBORPQBSA-N
Molecular Weight 289.331 g/mol
SMILES O[C@@]1([C@@]([C@]2(N(C)[C@](C1)([H])CC2)[H])(C(OC(=O)c1ccccc1)=O)[H])[H]
SPLASH splash10-000i-2900000000-a25111139073c2d4b4da
Source of Spectrum JZ-1992-311-0
Wiley ID 1292644