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2-Methoxycarbonylmethyl-3-(1-benzyloxyethyl)cyclopentanone
SpectraBase Compound ID IPooiehiTEc
InChI InChI=1S/C17H22O4/c1-12(21-11-13-6-4-3-5-7-13)14-8-9-16(18)15(14)10-17(19)20-2/h3-7,12,14-15H,8-11H2,1-2H3/t12-,14-,15-/m1/s1
InChIKey VCLYBQLOIODOMG-BPLDGKMQSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xgaYITEnhf
Name 2-Methoxycarbonylmethyl-3-(1-benzyloxyethyl)cyclopentanone
Alternate Name(s) Methyl {2-[1-(benzyloxy)ethyl]-5-oxocyclopentyl}acetate [(1R,2S)-2-((R)-1-Benzyloxy-ethyl)-5-oxo-cyclopentyl]-acetic acid methyl ester
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Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-12(21-11-13-6-4-3-5-7-13)14-8-9-16(18)15(14)10-17(19)20-2/h3-7,12,14-15H,8-11H2,1-2H3/t12-,14-,15-/m1/s1
InChIKey VCLYBQLOIODOMG-BPLDGKMQSA-N
Molecular Weight 290.359 g/mol
SMILES [C@@]1([C@](CCC1=O)([C@](OCc1ccccc1)(C)[H])[H])(CC(=O)OC)[H]
SPLASH splash10-052f-8900000000-449d0436180131f1d535
Source of Spectrum H1-38-1538-6
Wiley ID 756362