John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9rRqcLAv41y SpectraBase Spectrum ID=2VqLcDmq1hV

(accessed ).
7-CYCLOHEPTATRIENYLIDEN-1,5-DI-TERT.-BUTYLBICYCLO-[2.2.1]-HEPTA-2,5-DIEN-2,3-DICARBONSAEURE-DIMETHYLESTER
SpectraBase Compound ID 9rRqcLAv41y
InChI InChI=1S/C26H32O4/c1-24(2,3)17-15-26(25(4,5)6)20(16-13-11-9-10-12-14-16)18(17)19(22(27)29-7)21(26)23(28)30-8/h9-15,18H,1-8H3/t18-,26+/m0/s1
InChIKey ZGZNSLNSXBJMQW-HFJWLAOPSA-N
Mol Weight 408.5 g/mol
Molecular Formula C26H32O4
Exact Mass 408.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VqLcDmq1hV
Name 7-CYCLOHEPTATRIENYLIDEN-1,5-DI-TERT.-BUTYLBICYCLO-[2.2.1]-HEPTA-2,5-DIEN-2,3-DICARBONSAEURE-DIMETHYLESTER
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32O4
InChI InChI=1S/C26H32O4/c1-24(2,3)17-15-26(25(4,5)6)20(16-13-11-9-10-12-14-16)18(17)19(22(27)29-7)21(26)23(28)30-8/h9-15,18H,1-8H3/t18-,26+/m0/s1
InChIKey ZGZNSLNSXBJMQW-HFJWLAOPSA-N
Literature Reference Author L.KNOTHE,J.WERP,H.BABSCH,H.PRINZBACH,H.FRITZ
Literature Reference Citation LIEB.ANN.CHEM.,709(1977)
Molecular Weight 408.538 g/mol
Solvent CDCl3
Source File Reference UNIW14608
SpectraBase Batch ID ANwJACi3tEY