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(1R,2S,4R,5S)-2-(3-furanyl)-2,4-dihydroxy-5-methyl-1-cyclohexanecarboxylic acid ethyl ester
SpectraBase Compound ID GvRca8weayN
InChI InChI=1S/C14H20O5/c1-3-19-13(16)11-6-9(2)12(15)7-14(11,17)10-4-5-18-8-10/h4-5,8-9,11-12,15,17H,3,6-7H2,1-2H3/t9-,11-,12+,14+/m0/s1
InChIKey VOGZYBBSSXZSEH-PQFRYHKHSA-N
Mol Weight 268.31 g/mol
Molecular Formula C14H20O5
Exact Mass 268.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73ji3uZ4dJJ
Name (1R,2S,4R,5S)-2-(3-furanyl)-2,4-dihydroxy-5-methyl-1-cyclohexanecarboxylic acid ethyl ester
Alternate Name(s) (1R,2S,4R,5S)-2-(3-furyl)-2,4-dihydroxy-5-methyl-cyclohexanecarboxylic acid ethyl ester ethyl (1R,2S,4R,5S)-2-(3-furyl)-2,4-dihydroxy-5-methyl-cyclohexanecarboxylate ethyl (1R,2S,4R,5S)-2-(furan-3-yl)-2,4-dihydroxy-5-methylcyclohexane-1-carboxylate ethyl (1R,2S,4R,5S)-2-(furan-3-yl)-5-methyl-2,4-bis(oxidanyl)cyclohexane-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O5
InChI InChI=1S/C14H20O5/c1-3-19-13(16)11-6-9(2)12(15)7-14(11,17)10-4-5-18-8-10/h4-5,8-9,11-12,15,17H,3,6-7H2,1-2H3/t9-,11-,12+,14+/m0/s1
InChIKey VOGZYBBSSXZSEH-PQFRYHKHSA-N
Molecular Weight 268.309 g/mol
SMILES O[C@]1([C@](C[C@]([C@@](C1)(c1cocc1)O)(C(=O)OCC)[H])(C)[H])[H]
SPLASH splash10-0002-9010000000-353bf37c817ee10a1406
Source of Spectrum KC-1993-1499-19
Wiley ID 778186