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(1'S,R,4'S,R)-2-[4'-(Dicarbethoxymethyl)cyclopent-2'-enyl]ethanoic acid
SpectraBase Compound ID JhbMIErTZmK
InChI InChI=1S/C14H20O6/c1-3-19-13(17)12(14(18)20-4-2)10-6-5-9(7-10)8-11(15)16/h5-6,9-10,12H,3-4,7-8H2,1-2H3,(H,15,16)/t9-,10+/m0/s1
InChIKey IHRRNARXVRMLJF-VHSXEESVSA-N
Mol Weight 284.31 g/mol
Molecular Formula C14H20O6
Exact Mass 284.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4R5hAei7vG2
Name (1'S,R,4'S,R)-2-[4'-(Dicarbethoxymethyl)cyclopent-2'-enyl]ethanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O6
InChI InChI=1S/C14H20O6/c1-3-19-13(17)12(14(18)20-4-2)10-6-5-9(7-10)8-11(15)16/h5-6,9-10,12H,3-4,7-8H2,1-2H3,(H,15,16)/t9-,10+/m0/s1
InChIKey IHRRNARXVRMLJF-VHSXEESVSA-N
Molecular Weight 284.308 g/mol
SMILES OC(C[C@@]1(C[C@](C(C(=O)OCC)C(=O)OCC)(C=C1)[H])[H])=O
SPLASH splash10-00di-0090000000-cc0afd4df7999e1cea7f
Source of Spectrum J-62-4671-0
Synonyms {(1S,4S)-4-[2-ethoxy-1-(ethoxycarbonyl)-2-oxoethyl]-2-cyclopenten-1-yl}acetic acid
Wiley ID 1287653