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2'-(A,A-Dimethyl-benzyl)-angelicin

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2'-(A,A-Dimethyl-benzyl)-angelicin
SpectraBase Compound ID 7BrPZ0IHHoD
InChI InChI=1S/C20H16O3/c1-20(2,14-6-4-3-5-7-14)17-12-15-16(22-17)10-8-13-9-11-18(21)23-19(13)15/h3-12H,1-2H3
InChIKey ZPZPQZYIZHBLBM-UHFFFAOYSA-N
Mol Weight 304.35 g/mol
Molecular Formula C20H16O3
Exact Mass 304.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ZZGDjDYvCL
Name 2'-(A,A-Dimethyl-benzyl)-angelicin
CAS Registry Number 55710-65-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H16O3
InChI InChI=1S/C20H16O3/c1-20(2,14-6-4-3-5-7-14)17-12-15-16(22-17)10-8-13-9-11-18(21)23-19(13)15/h3-12H,1-2H3
InChIKey ZPZPQZYIZHBLBM-UHFFFAOYSA-N
Literature Reference H. Duddeck, M. Kaiser, Org. Magn. Resonance 20, 55 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3