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(3S,4R,5S)-3-ethyl-5-(iodanylmethyl)-4-methyl-oxolan-2-one
SpectraBase Compound ID JWdaGy2yq5N
InChI InChI=1S/C8H13IO2/c1-3-6-5(2)7(4-9)11-8(6)10/h5-7H,3-4H2,1-2H3/t5-,6+,7-/m1/s1
InChIKey FYRYJBRMQSUTCA-DSYKOEDSSA-N
Mol Weight 268.09 g/mol
Molecular Formula C8H13IO2
Exact Mass 267.996025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ga6AhAYY2mh
Name (3S,4R,5S)-3-ethyl-5-(iodanylmethyl)-4-methyl-oxolan-2-one
Alternate Name(s) (3S,4R,5S)-3-ethyl-5-(iodomethyl)-4-methyl-2-oxolanone (3S,4R,5S)-3-ethyl-5-(iodomethyl)-4-methyl-tetrahydrofuran-2-one (3S,4R,5S)-3-ethyl-5-(iodomethyl)-4-methyloxolan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H13IO2
InChI InChI=1S/C8H13IO2/c1-3-6-5(2)7(4-9)11-8(6)10/h5-7H,3-4H2,1-2H3/t5-,6+,7-/m1/s1
InChIKey FYRYJBRMQSUTCA-DSYKOEDSSA-N
Molecular Weight 268.094 g/mol
SMILES C1(O[C@](CI)([C@@]([C@@]1(CC)[H])(C)[H])[H])=O
SPLASH splash10-0a4i-9010000000-0eb2e7b5cf5dab037f87
Source of Spectrum J-62-4447-8
Wiley ID 1271540