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REL-(1R,3R,4S)-5-CHLORO-4-HYDROXY-6-METHOXY-1,3-DIMETHYL-2-BENZOPYRAN
SpectraBase Compound ID DuqgvMc4zkW
InChI InChI=1S/C12H15ClO3/c1-6-8-4-5-9(15-3)11(13)10(8)12(14)7(2)16-6/h4-7,12,14H,1-3H3/t6-,7-,12-/m1/s1
InChIKey UXCHUZAFBLXZNU-NQYJQULFSA-N
Mol Weight 242.7 g/mol
Molecular Formula C12H15ClO3
Exact Mass 242.070972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VJZqvIRPlG
Name REL-(1R,3R,4S)-5-CHLORO-4-HYDROXY-6-METHOXY-1,3-DIMETHYL-2-BENZOPYRAN
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15ClO3
InChI InChI=1S/C12H15ClO3/c1-6-8-4-5-9(15-3)11(13)10(8)12(14)7(2)16-6/h4-7,12,14H,1-3H3/t6-,7-,12-/m1/s1
InChIKey UXCHUZAFBLXZNU-NQYJQULFSA-N
Literature Reference Author R.G.F.GILES,I.R.GREEN,S.H.LI
Literature Reference Citation AUSTR.J.CHEM.,58,565(2005)
Literature Reference DOI 10.1071/CH05120
Molecular Weight 242.702 g/mol
Sample ID 28982
Solvent CDCl3