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(4R*,4A-S*,8A-R*)-(+/-)-2-PHENYL-4-(4-METHOXYPHENYL)-1,4,4A,5,6,7,8,8A-OCTAHYDRO-1,8-DIOXA-NAPHTHO-3-CARBO
SpectraBase Compound ID EfZzwKGJMfk
InChI InChI=1S/C22H21NO3/c1-24-17-11-9-15(10-12-17)20-18-8-5-13-25-22(18)26-21(19(20)14-23)16-6-3-2-4-7-16/h2-4,6-7,9-12,18,20,22H,5,8,13H2,1H3/t18-,20-,22+/m0/s1
InChIKey VCFFDMNYNVJHFE-RCZSKKKRSA-N
Mol Weight 347.41 g/mol
Molecular Formula C22H21NO3
Exact Mass 347.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JbqoeWVIbZ4
Name (4R*,4A-S*,8A-R*)-(+/-)-2-PHENYL-4-(4-METHOXYPHENYL)-1,4,4A,5,6,7,8,8A-OCTAHYDRO-1,8-DIOXA-NAPHTHO-3-CARBO
Compound Number 6CNITRILE;6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21NO3
InChI InChI=1S/C22H21NO3/c1-24-17-11-9-15(10-12-17)20-18-8-5-13-25-22(18)26-21(19(20)14-23)16-6-3-2-4-7-16/h2-4,6-7,9-12,18,20,22H,5,8,13H2,1H3/t18-,20-,22+/m0/s1
InChIKey VCFFDMNYNVJHFE-RCZSKKKRSA-N
Literature Reference Author K.BOGDANOWICZ-SZWED,A.PALASZ
Literature Reference Citation MH.CHEM.,128,1157(1997)
Literature Reference DOI 10.1007/BF00807566
Molecular Weight 347.414 g/mol
Solvent CDCl3
Source File Reference UWRK2941