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DL-(1.alpha.,2.alpha.,4.alpha.,5.alpha.,7.alpha.,8.alpha.)-6-(4-phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane

View entire compound with spectra: 1 MS (GC)

DL-(1.alpha.,2.alpha.,4.alpha.,5.alpha.,7.alpha.,8.alpha.)-6-(4-phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
SpectraBase Compound ID 2Uq8dhubcbM
InChI InChI=1S/C13H13NO3S/c15-18(16,7-4-2-1-3-5-7)14-10-8-6-9(8)12-13(17-12)11(10)14/h1-5,8-13H,6H2/t8-,9+,10-,11-,12+,13-,14?/m1/s1
InChIKey QQSBQLAJIVVQBK-ZFGMARDJSA-N
Mol Weight 263.31 g/mol
Molecular Formula C13H13NO3S
Exact Mass 263.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E5O5nz6Hny6
Name DL-(1.alpha.,2.alpha.,4.alpha.,5.alpha.,7.alpha.,8.alpha.)-6-(4-phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
Alternate Name(s) (1S,2S,4R,5R,7R,8R)-6-(phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
CAS Registry Number 112297-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3S
InChI InChI=1S/C13H13NO3S/c15-18(16,7-4-2-1-3-5-7)14-10-8-6-9(8)12-13(17-12)11(10)14/h1-5,8-13H,6H2/t8-,9+,10-,11-,12+,13-,14?/m1/s1
InChIKey QQSBQLAJIVVQBK-ZFGMARDJSA-N
Molecular Weight 263.311 g/mol
SMILES [C@]12(N([C@@]1([C@]1([C@@]([C@]3([C@@]2(O3)[H])[H])(C1)[H])[H])[H])S(=O)(=O)c1ccccc1)[H]
SPLASH splash10-00di-0900000000-8a80c198fc1492c8530b
Source of Spectrum K-121-777-5
Wiley ID 1266763