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cis-10,11,12,13-Tetraphenyl-5-oxatricyclo[7.4.0.0(4,6)]trideca-1(9),10,12-triene

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cis-10,11,12,13-Tetraphenyl-5-oxatricyclo[7.4.0.0(4,6)]trideca-1(9),10,12-triene
SpectraBase Compound ID IwD86txya0R
InChI InChI=1S/C36H30O/c1-5-13-25(14-6-1)33-29-21-23-31-32(37-31)24-22-30(29)34(26-15-7-2-8-16-26)36(28-19-11-4-12-20-28)35(33)27-17-9-3-10-18-27/h1-20,31-32H,21-24H2/t31-,32+
InChIKey GCEFNZHNYUNZIM-MEKGRNQZSA-N
Mol Weight 478.6 g/mol
Molecular Formula C36H30O
Exact Mass 478.229666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HykjhWuByr
Name cis-10,11,12,13-Tetraphenyl-5-oxatricyclo[7.4.0.0(4,6)]trideca-1(9),10,12-triene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.229665585 u
Formula C36H30O
InChI InChI=1S/C36H30O/c1-5-13-25(14-6-1)33-29-21-23-31-32(37-31)24-22-30(29)34(26-15-7-2-8-16-26)36(28-19-11-4-12-20-28)35(33)27-17-9-3-10-18-27/h1-20,31-32H,21-24H2/t31-,32+
InChIKey GCEFNZHNYUNZIM-MEKGRNQZSA-N
Molecular Weight 478.635 g/mol
SMILES C12=C(C(C=3C=CC=CC3)=C(C(=C1C1=CC=CC=C1)C=1C=CC=CC1)C=1C=CC=CC1)CC[C@]1([C@](O1)(CC2)[H])[H]