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Aristogin B

View entire compound with spectra: 2 MS (GC)

Aristogin B
SpectraBase Compound ID BzqxnzVSckA
InChI InChI=1S/C16H14O5/c1-19-14-8-5-12(16(18)20-2)9-15(14)21-13-6-3-11(10-17)4-7-13/h3-10H,1-2H3
InChIKey IQLDYSJYDUZNNV-UHFFFAOYSA-N
Mol Weight 286.28 g/mol
Molecular Formula C16H14O5
Exact Mass 286.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNYHBR9uFHD
Name Aristogin B
Alternate Name(s) 3-(4-formylphenoxy)-4-methoxy-benzoic acid methyl ester Methyl 3-(4'-formylphenoxy)-4-methoxybenzoate 3-(4-formylphenoxy)-4-methoxybenzoic acid methyl ester Methyl 3-(4-formylphenoxy)-4-methoxy-benzoate Methyl 3-(4-formylphenoxy)-4-methoxybenzoate Methyl 3-(4-methanoylphenoxy)-4-methoxy-benzoate
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Formula C16H14O5
InChI InChI=1S/C16H14O5/c1-19-14-8-5-12(16(18)20-2)9-15(14)21-13-6-3-11(10-17)4-7-13/h3-10H,1-2H3
InChIKey IQLDYSJYDUZNNV-UHFFFAOYSA-N
Molecular Weight 286.283 g/mol
SMILES c1(Oc2c(ccc(c2)C(=O)OC)OC)ccc(cc1)C=O
SPLASH splash10-052r-0090000000-490355134f2b3609d63b
Source of Spectrum D9-7-313-10
Wiley ID 1546260