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(2S)-2-[(2R,5S,6R)-6-[(1E)-1-(iodomethylene)propyl]-5-methyl-tetrahydropyran-2-yl]propan-1-ol
SpectraBase Compound ID E01vJab2OeM
InChI InChI=1S/C13H23IO2/c1-4-11(7-14)13-9(2)5-6-12(16-13)10(3)8-15/h7,9-10,12-13,15H,4-6,8H2,1-3H3/b11-7+/t9-,10-,12+,13+/m0/s1
InChIKey BFSKIQUOHWTQIC-ZCWHDKNASA-N
Mol Weight 338.23 g/mol
Molecular Formula C13H23IO2
Exact Mass 338.074275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GprWqYLvon1
Name (2S)-2-[(2R,5S,6R)-6-[(1E)-1-(iodomethylene)propyl]-5-methyl-tetrahydropyran-2-yl]propan-1-ol
Alternate Name(s) (2S)-2-[(2R,5S,6R)-6-[(E)-1-ethyl-2-iodo-vinyl]-5-methyl-tetrahydropyran-2-yl]propan-1-ol (2S)-2-[(2R,5S,6R)-6-[(E)-1-iodanylbut-1-en-2-yl]-5-methyl-oxan-2-yl]propan-1-ol (2S)-2-[(2R,5S,6R)-6-[(E)-1-iodobut-1-en-2-yl]-5-methyl-2-oxanyl]-1-propanol (2S)-2-[(2R,5S,6R)-6-[(E)-1-iodobut-1-en-2-yl]-5-methyloxan-2-yl]propan-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C13H23IO2
InChI InChI=1S/C13H23IO2/c1-4-11(7-14)13-9(2)5-6-12(16-13)10(3)8-15/h7,9-10,12-13,15H,4-6,8H2,1-3H3/b11-7+/t9-,10-,12+,13+/m0/s1
InChIKey BFSKIQUOHWTQIC-ZCWHDKNASA-N
Molecular Weight 338.229 g/mol
SMILES OC[C@@]([C@@]1(O[C@@](\C(=C\I)CC)([C@@](C)(CC1)[H])[H])[H])(C)[H]
SPLASH splash10-03di-0090000000-5634abbc64f384619593
Source of Spectrum J-59-342-27
Wiley ID 1333403