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(1R,3S)-3-(acetoxymethyl)-2,2-dimethyl-cyclobutanecarboxylic acid ethyl ester
SpectraBase Compound ID IoTo0opP3X8
InChI InChI=1S/C12H20O4/c1-5-15-11(14)10-6-9(12(10,3)4)7-16-8(2)13/h9-10H,5-7H2,1-4H3/t9-,10+/m1/s1
InChIKey DUTFXNIGEFTEHO-ZJUUUORDSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F8T9PdEOTh3
Name (1R,3S)-3-(acetoxymethyl)-2,2-dimethyl-cyclobutanecarboxylic acid ethyl ester
Alternate Name(s) (1R,3S)-3-(acetyloxymethyl)-2,2-dimethyl-1-cyclobutanecarboxylic acid ethyl ester Ethyl (1R,3S)-3-(acetoxymethyl)-2,2-dimethyl-cyclobutanecarboxylate Ethyl (1R,3S)-3-(acetyloxymethyl)-2,2-dimethyl-cyclobutane-1-carboxylate
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Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-5-15-11(14)10-6-9(12(10,3)4)7-16-8(2)13/h9-10H,5-7H2,1-4H3/t9-,10+/m1/s1
InChIKey DUTFXNIGEFTEHO-ZJUUUORDSA-N
Molecular Weight 228.288 g/mol
SMILES [C@]1(C(C)(C)[C@](C1)(COC(=O)C)[H])(C(=O)OCC)[H]
SPLASH splash10-014l-9100000000-cddc1fa2bdd29058abbe
Source of Spectrum F-48-1939-23
Wiley ID 1229579