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1-(2-benzoxy-6-hydroxy-phenyl)-9-(3,4-dimethoxyphenyl)-3-hydroxy-nonan-1-one
SpectraBase Compound ID 1XkcKvAU9b7
InChI InChI=1S/C30H36O6/c1-34-27-18-17-22(19-29(27)35-2)11-6-3-4-9-14-24(31)20-26(33)30-25(32)15-10-16-28(30)36-21-23-12-7-5-8-13-23/h5,7-8,10,12-13,15-19,24,31-32H,3-4,6,9,11,14,20-21H2,1-2H3
InChIKey LEBMBSUXPBBPBU-UHFFFAOYSA-N
Mol Weight 492.6 g/mol
Molecular Formula C30H36O6
Exact Mass 492.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRLKd82vgnO
Name 1-(2-benzoxy-6-hydroxy-phenyl)-9-(3,4-dimethoxyphenyl)-3-hydroxy-nonan-1-one
Alternate Name(s) 1-(2-benzyloxy-6-hydroxy-phenyl)-9-(3,4-dimethoxyphenyl)-3-hydroxy-nonan-1-one 9-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)-1-nonanone 9-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)nonan-1-one 9-(3,4-dimethoxyphenyl)-3-oxidanyl-1-(2-oxidanyl-6-phenylmethoxy-phenyl)nonan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C30H36O6
InChI InChI=1S/C30H36O6/c1-34-27-18-17-22(19-29(27)35-2)11-6-3-4-9-14-24(31)20-26(33)30-25(32)15-10-16-28(30)36-21-23-12-7-5-8-13-23/h5,7-8,10,12-13,15-19,24,31-32H,3-4,6,9,11,14,20-21H2,1-2H3
InChIKey LEBMBSUXPBBPBU-UHFFFAOYSA-N
Molecular Weight 492.612 g/mol
SMILES OC(CC(c1c(cccc1OCc1ccccc1)O)=O)CCCCCCc1cc(c(cc1)OC)OC
SPLASH splash10-0006-9000000000-f2ecb980dcac7112132b
Source of Spectrum E1-39-21-16
Wiley ID 1518660