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2-NITRO-3-(PARA-TOLYLSULFONYLMETHYL)-BICYClO-[4.4.1]-UNDECA-1,3,5,7,9-PENTAENE
SpectraBase Compound ID 3cBuDmTIYBN
InChI InChI=1S/C19H17NO4S/c1-14-6-10-18(11-7-14)25(23,24)13-17-9-8-15-4-2-3-5-16(12-15)19(17)20(21)22/h2-11H,12-13H2,1H3
InChIKey GVBQTZQDYNVZME-UHFFFAOYSA-N
Mol Weight 355.41 g/mol
Molecular Formula C19H17NO4S
Exact Mass 355.087829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GYm2ZrtU4aP
Name 2-NITRO-3-(PARA-TOLYLSULFONYLMETHYL)-BICYClO-[4.4.1]-UNDECA-1,3,5,7,9-PENTAENE
CAS Registry Number 170645-45-1
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17NO4S
InChI InChI=1S/C19H17NO4S/c1-14-6-10-18(11-7-14)25(23,24)13-17-9-8-15-4-2-3-5-16(12-15)19(17)20(21)22/h2-11H,12-13H2,1H3
InChIKey GVBQTZQDYNVZME-UHFFFAOYSA-N
Literature Reference Author S.OSTROWSKI,R.J.MORITZ,B.MUDRYK
Literature Reference Citation MH.CHEM.,126,447(1995)
Literature Reference DOI 10.1007/BF00813207
Molecular Weight 355.408 g/mol
Solvent ACETONITRILE-D3
Source File Reference UWMK23