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(4S,5S)-(+)-5-[1'-Iodo-1'(Z)-butenyl]-4-methyl-4,5-dihydro-2(3H)-furanone
SpectraBase Compound ID IYz1WDKwKRj
InChI InChI=1S/C9H13IO2/c1-3-4-7(10)9-6(2)5-8(11)12-9/h4,6,9H,3,5H2,1-2H3/b7-4-/t6-,9-/m0/s1
InChIKey JTOXABMHDIATIZ-AWDXAEIFSA-N
Mol Weight 280.11 g/mol
Molecular Formula C9H13IO2
Exact Mass 279.996025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EC3XfbAyVL8
Name (4S,5S)-(+)-5-[1'-Iodo-1'(Z)-butenyl]-4-methyl-4,5-dihydro-2(3H)-furanone
Alternate Name(s) (4S,5S)-5-[(Z)-1-iodobut-1-enyl]-4-methyl-2-oxolanone (4S,5S)-5-[(Z)-1-iodobut-1-enyl]-4-methyloxolan-2-one (4S,5S)-5-[(Z)-1-iodanylbut-1-enyl]-4-methyl-oxolan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C9H13IO2
InChI InChI=1S/C9H13IO2/c1-3-4-7(10)9-6(2)5-8(11)12-9/h4,6,9H,3,5H2,1-2H3/b7-4-/t6-,9-/m0/s1
InChIKey JTOXABMHDIATIZ-AWDXAEIFSA-N
Molecular Weight 280.105 g/mol
SMILES [C@]1(OC(C[C@@]1(C)[H])=O)(\C(=C\CC)I)[H]
SPLASH splash10-001i-9050000000-06ab80eab1376f46a997
Source of Spectrum U1-2010-692-6
Wiley ID 1663334