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2-Methoxy-4-[4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)phenyl]carbonyloxy-6-(2-oxidanylidenenonyl)benzoic acid
SpectraBase Compound ID HhIKV5Ik10O
InChI InChI=1S/C32H42O9/c1-5-7-9-10-12-14-24(34)16-22-18-26(20-28(40-4)30(22)31(36)37)41-32(38)29-21(15-23(33)13-11-8-6-2)17-25(39-3)19-27(29)35/h17-20,35H,5-16H2,1-4H3,(H,36,37)
InChIKey KLQPNSINZNPRSF-UHFFFAOYSA-N
Mol Weight 570.7 g/mol
Molecular Formula C32H42O9
Exact Mass 570.282883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91hJ8PXlIh6
Name 2-Methoxy-4-[4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)phenyl]carbonyloxy-6-(2-oxidanylidenenonyl)benzoic acid
Alternate Name(s) 4-[2-hydroxy-6-(2-ketoheptyl)-4-methoxy-benzoyl]oxy-2-(2-ketononyl)-6-methoxy-benzoic acid 4-[[2-hydroxy-4-methoxy-6-(2-oxoheptyl)phenyl]-oxomethoxy]-2-methoxy-6-(2-oxononyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42O9
InChI InChI=1S/C32H42O9/c1-5-7-9-10-12-14-24(34)16-22-18-26(20-28(40-4)30(22)31(36)37)41-32(38)29-21(15-23(33)13-11-8-6-2)17-25(39-3)19-27(29)35/h17-20,35H,5-16H2,1-4H3,(H,36,37)
InChIKey KLQPNSINZNPRSF-UHFFFAOYSA-N
Molecular Weight 570.679 g/mol
SMILES OC(c1c(cc(OC(c2c(cc(cc2CC(=O)CCCCC)OC)O)=O)cc1CC(=O)CCCCCCC)OC)=O
SPLASH splash10-03di-0910000000-3f0d4b1dc9e3aa8db78c
Source of Spectrum B-50-485-45
Wiley ID 745659