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Cylindol A

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Cylindol A
SpectraBase Compound ID 9UpVYAT5Lxt
InChI InChI=1S/C16H14O7/c1-21-15(19)9-3-5-11(17)13(7-9)23-14-8-10(16(20)22-2)4-6-12(14)18/h3-8,17-18H,1-2H3
InChIKey OEYSNLOOZVNLRA-UHFFFAOYSA-N
Mol Weight 318.28 g/mol
Molecular Formula C16H14O7
Exact Mass 318.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NoqkUx2aac
Name Cylindol A
Alternate Name(s) 3-(5-carbomethoxy-2-hydroxy-phenoxy)-4-hydroxy-benzoic acid methyl ester 4-Hydroxy-3-(2-hydroxy-5-methoxycarbonylphenoxy)benzoic acid methyl ester Methyl 3-(5-methoxycarbonyl-2-oxidanyl-phenoxy)-4-oxidanyl-benzoate Methyl 4-hydroxy-3-(2-hydroxy-5-methoxycarbonylphenoxy)benzoate
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Formula C16H14O7
InChI InChI=1S/C16H14O7/c1-21-15(19)9-3-5-11(17)13(7-9)23-14-8-10(16(20)22-2)4-6-12(14)18/h3-8,17-18H,1-2H3
InChIKey OEYSNLOOZVNLRA-UHFFFAOYSA-N
Molecular Weight 318.281 g/mol
SMILES Oc1ccc(cc1Oc1c(ccc(c1)C(=O)OC)O)C(=O)OC
SPLASH splash10-00kr-0193000000-6a438a4f48ff75fbee0a
Source of Spectrum X2-57-1292-1
Wiley ID 1605622