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DL-(1.alpha.,2.beta.,4.beta.,5.beta.,7.beta.,8.beta.)-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.beta.,4.beta.,5.beta.,7.beta.,8.beta.)-6-(4-phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
SpectraBase Compound ID LydxXXg2PNt
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?/m0/s1
InChIKey QQSBQLAJIVVQBK-QOZDAZPGSA-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 HHLVuyJnECQ
Name DL-(1.alpha.,2.beta.,4.beta.,5.beta.,7.beta.,8.beta.)-6-(4-phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
CAS Registry Number 112419-25-7
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?/m0/s1
InChIKey QQSBQLAJIVVQBK-QOZDAZPGSA-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 splash10-004i-9100000000-5f6f0debc9492d236636
Source of Spectrum K-121-778-10
Synonyms (1S,2R,4S,5S,7S,8S)-6-(phenylsulfonyl)-3-oxa-6-azatetracyclo[6.1.0.0(2,4).0(5,7)]nonane
Wiley ID 1266764