John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6gY8ncKnbRv SpectraBase Spectrum ID=2AfkmgZreJm

(accessed ).
3',5',7,9-TETRA-(TERT.-BUTYL)-5-ETHYLSPIRO-[1,3-BENZOXATHIEPIN-4(5H),1'-CYCLOHEXA-[2,4]-DIENE]-2,2'-DIONE
SpectraBase Compound ID 6gY8ncKnbRv
InChI InChI=1S/C32H46O3S/c1-14-22-21-15-19(28(2,3)4)16-23(30(8,9)10)25(21)35-27(34)36-32(22)18-20(29(5,6)7)17-24(26(32)33)31(11,12)13/h15-18,22H,14H2,1-13H3
InChIKey VNQBNVISLLXUHD-UHFFFAOYSA-N
Mol Weight 510.8 g/mol
Molecular Formula C32H46O3S
Exact Mass 510.316767 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AfkmgZreJm
Name 3',5',7,9-TETRA-(TERT.-BUTYL)-5-ETHYLSPIRO-[1,3-BENZOXATHIEPIN-4(5H),1'-CYCLOHEXA-[2,4]-DIENE]-2,2'-DIONE
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Formula C32H46O3S
InChI InChI=1S/C32H46O3S/c1-14-22-21-15-19(28(2,3)4)16-23(30(8,9)10)25(21)35-27(34)36-32(22)18-20(29(5,6)7)17-24(26(32)33)31(11,12)13/h15-18,22H,14H2,1-13H3
InChIKey VNQBNVISLLXUHD-UHFFFAOYSA-N
Literature Reference Author S.KOLLY,H.MEIER,T.WINKLER
Literature Reference Citation HELV.CHIM.ACTA,75,729(1992)
Literature Reference DOI 10.1002/hlca.19920750308
Molecular Weight 510.775 g/mol
Solvent CDCl3
Source File Reference UWCS7063
SpectraBase Batch ID BJZr4yq12YE