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5-tert-Butyl-3,3-diphenyl-3aa, 4,5a,6-tetrahydro-1(3H)-isobenzofuranone
SpectraBase Compound ID 35t896FOXYW
InChI InChI=1S/C24H26O2/c1-23(2,3)19-14-15-20-21(16-19)24(26-22(20)25,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,15,19,21H,14,16H2,1-3H3/t19-,21+/m1/s1
InChIKey QCBOQEKQVJTCFU-CTNGQTDRSA-N
Mol Weight 346.47 g/mol
Molecular Formula C24H26O2
Exact Mass 346.19328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jt74P1vni6G
Name 5-tert-Butyl-3,3-diphenyl-3aa, 4,5a,6-tetrahydro-1(3H)-isobenzofuranone
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H26O2
InChI InChI=1S/C24H26O2/c1-23(2,3)19-14-15-20-21(16-19)24(26-22(20)25,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,15,19,21H,14,16H2,1-3H3/t19-,21+/m1/s1
InChIKey QCBOQEKQVJTCFU-CTNGQTDRSA-N
Literature Reference P. Beak, D.J. Kempf, K.D. Wilson, J. Am. Chem. Soc. 107, 4745 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3