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(2R,3aR)-2-Hydroxymethyl-3,3a,4,5,6,7-hexahydro-2H-cyclohepta[b]furan-8-carboxylic acid ethyl ester
SpectraBase Compound ID 9HQUxxLohvI
InChI InChI=1S/C13H20O4/c1-2-16-13(15)11-6-4-3-5-9-7-10(8-14)17-12(9)11/h9-10,14H,2-8H2,1H3/t9-,10-/m1/s1
InChIKey HHRUHYDVTKDONC-NXEZZACHSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16Aa0VhHMK5
Name (2R,3aR)-2-Hydroxymethyl-3,3a,4,5,6,7-hexahydro-2H-cyclohepta[b]furan-8-carboxylic acid ethyl ester
Alternate Name(s) Ethyl (2R,3aR)-2-(hydroxymethyl)-3,3a,4,5,6,7-hexahydro-2H-cyclohepta[b]furan-8-carboxylate Ethyl 2-(Hydroxymethyl)hexahydro-3aH-cyclohepta[b]furan-8-carboxylate
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Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-2-16-13(15)11-6-4-3-5-9-7-10(8-14)17-12(9)11/h9-10,14H,2-8H2,1H3/t9-,10-/m1/s1
InChIKey HHRUHYDVTKDONC-NXEZZACHSA-N
Molecular Weight 240.299 g/mol
SMILES OC[C@@]1(OC2=C(C(=O)OCC)CCCC[C@@]2(C1)[H])[H]
SPLASH splash10-001a-0920000000-6bdda41a3580d28db655
Source of Spectrum QE-7-571-4
Wiley ID 845270