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8-CHLORO-2-(2-PHENYLETHYL)-5,6,7-TRIHYDROXY-5,6,7,8-TETRAHYDRO-CHROMONE
SpectraBase Compound ID GISDWBCtzdl
InChI InChI=1S/C17H17ClO5/c18-13-15(21)16(22)14(20)12-11(19)8-10(23-17(12)13)7-6-9-4-2-1-3-5-9/h1-5,8,13-16,20-22H,6-7H2/t13-,14+,15-,16+/m1/s1
InChIKey WCUYELNCMCEJQL-QXSJWSMHSA-N
Mol Weight 336.77 g/mol
Molecular Formula C17H17ClO5
Exact Mass 336.076451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lujt4BUdkXm
Name 8-CHLORO-2-(2-PHENYLETHYL)-5,6,7-TRIHYDROXY-5,6,7,8-TETRAHYDRO-CHROMONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17ClO5
InChI InChI=1S/C17H17ClO5/c18-13-15(21)16(22)14(20)12-11(19)8-10(23-17(12)13)7-6-9-4-2-1-3-5-9/h1-5,8,13-16,20-22H,6-7H2/t13-,14+,15-,16+/m1/s1
InChIKey WCUYELNCMCEJQL-QXSJWSMHSA-N
Literature Reference Author T.YAGURA,M.ITO,F.KIUCHI,G.HONDA,Y.SHIMADA
Literature Reference Citation CHEM.PHARM.BULL.,51,560(2003)
Literature Reference DOI 10.1248/cpb.51.560
Molecular Weight 336.772 g/mol
Solvent C5D5N
Source File Reference UWMS21391