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(1S,3R,4R)-3-(Toluene-4-sulfonyloxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylic Acid tert-Butyl Ester
SpectraBase Compound ID 7hcsVFKbqBp
InChI InChI=1S/C19H27NO5S/c1-13-5-9-16(10-6-13)26(22,23)24-12-17-14-7-8-15(11-14)20(17)18(21)25-19(2,3)4/h5-6,9-10,14-15,17H,7-8,11-12H2,1-4H3/t14-,15+,17+/m1/s1
InChIKey IZMXZCRJRQDMBQ-VYDXJSESSA-N
Mol Weight 381.49 g/mol
Molecular Formula C19H27NO5S
Exact Mass 381.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fv8FoNc3FO1
Name (1S,3R,4R)-3-(Toluene-4-sulfonyloxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylic Acid tert-Butyl Ester
Alternate Name(s) (1S,3R,4R)-tert-butyl 3-((tosyloxy)methyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate (1R,2R,4S)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-azabicyclo[2.2.1]heptane-3-carboxylic acid tert-butyl ester tert-Butyl (1R,2R,4S)-2-(p-tolylsulfonyloxymethyl)-3-azabicyclo[2.2.1]heptane-3-carboxylate tert-Butyl (1R,2R,4S)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-azabicyclo[2.2.1]heptane-3-carboxylate
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Formula C19H27NO5S
InChI InChI=1S/C19H27NO5S/c1-13-5-9-16(10-6-13)26(22,23)24-12-17-14-7-8-15(11-14)20(17)18(21)25-19(2,3)4/h5-6,9-10,14-15,17H,7-8,11-12H2,1-4H3/t14-,15+,17+/m1/s1
InChIKey IZMXZCRJRQDMBQ-VYDXJSESSA-N
Literature Reference DOI 10.1002/adsc.200303238
Molecular Weight 381.487 g/mol
SMILES C(OS(=O)(c1ccc(cc1)C)=O)[C@@]1(N([C@]2(CC[C@@]1(C2)[H])[H])C(OC(C)(C)C)=O)[H]
SPLASH splash10-014i-9300000000-48bc0326591e54c02b59
Source of Spectrum ASC-346-551-5
Wiley ID 1767600