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(3S,4R,5S)-5-(iodanylmethyl)-3,4,5-trimethyl-oxolan-2-one
SpectraBase Compound ID 6CS4on8JfvG
InChI InChI=1S/C8H13IO2/c1-5-6(2)8(3,4-9)11-7(5)10/h5-6H,4H2,1-3H3/t5-,6+,8+/m0/s1
InChIKey YLQBKNDTOFYMAI-SHYZEUOFSA-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 HpUGOjXbJQn
Name (3S,4R,5S)-5-(iodanylmethyl)-3,4,5-trimethyl-oxolan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H13IO2
InChI InChI=1S/C8H13IO2/c1-5-6(2)8(3,4-9)11-7(5)10/h5-6H,4H2,1-3H3/t5-,6+,8+/m0/s1
InChIKey YLQBKNDTOFYMAI-SHYZEUOFSA-N
Molecular Weight 268.094 g/mol
SMILES C1(O[C@@](CI)(C)[C@@]([C@@]1(C)[H])(C)[H])=O
SPLASH splash10-004i-0900000000-0fae017270ea74f20089
Source of Spectrum J-62-4447-8
Synonyms (3S,4R,5S)-5-(iodomethyl)-3,4,5-trimethyl-2-oxolanone (3S,4R,5S)-5-(iodomethyl)-3,4,5-trimethyl-tetrahydrofuran-2-one (3S,4R,5S)-5-(iodomethyl)-3,4,5-trimethyloxolan-2-one
Wiley ID 1271538