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4-Acetoxymethyl-5-[2-(2-iodoethyl)phenyl]tetrahydrofuran-2-one
SpectraBase Compound ID 92n8nWtIzJB
InChI InChI=1S/C15H17IO4/c1-10(17)19-9-12-8-14(18)20-15(12)13-5-3-2-4-11(13)6-7-16/h2-5,12,15H,6-9H2,1H3/t12-,15-/m0/s1
InChIKey NEIPGSGSCIGGML-WFASDCNBSA-N
Mol Weight 388.2 g/mol
Molecular Formula C15H17IO4
Exact Mass 388.017154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRFaGJbEQcH
Name 4-Acetoxymethyl-5-[2-(2-iodoethyl)phenyl]tetrahydrofuran-2-one
Alternate Name(s) Acetic acid (2S,3S)-2-[2-(2-iodo-ethyl)-phenyl]-5-oxo-tetrahydro-furan-3-ylmethyl ester {2-[2-(2-iodoethyl)phenyl]-5-oxotetrahydro-3-furanyl}methyl acetate
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Formula C15H17IO4
InChI InChI=1S/C15H17IO4/c1-10(17)19-9-12-8-14(18)20-15(12)13-5-3-2-4-11(13)6-7-16/h2-5,12,15H,6-9H2,1H3/t12-,15-/m0/s1
InChIKey NEIPGSGSCIGGML-WFASDCNBSA-N
Molecular Weight 388.201 g/mol
SMILES [C@]1(OC(=O)C[C@]1(COC(=O)C)[H])(c1c(CCI)cccc1)[H]
SPLASH splash10-0006-9000000000-15e3440669ba0577f178
Source of Spectrum KC-0-59-41
Wiley ID 782917