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(3S,4S,5S)-3-Methyl-2-oxo-5-tridecyl-4-vinyltetrahydrofuran
SpectraBase Compound ID 6NPoxPxwF51
InChI InChI=1S/C20H36O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-19-18(5-2)17(3)20(21)22-19/h5,17-19H,2,4,6-16H2,1,3H3/t17-,18-,19-/m0/s1
InChIKey SGYYDTUHWHCGTI-FHWLQOOXSA-N
Mol Weight 308.5 g/mol
Molecular Formula C20H36O2
Exact Mass 308.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9CHgS4tsLuj
Name (3S,4S,5S)-3-Methyl-2-oxo-5-tridecyl-4-vinyltetrahydrofuran
CAS Registry Number 133604-26-9
Comments Less than 3 mono-isotopic peaks
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Formula C20H36O2
InChI InChI=1S/C20H36O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-19-18(5-2)17(3)20(21)22-19/h5,17-19H,2,4,6-16H2,1,3H3/t17-,18-,19-/m0/s1
InChIKey SGYYDTUHWHCGTI-FHWLQOOXSA-N
Molecular Weight 308.506 g/mol
SMILES C1(O[C@@](CCCCCCCCCCCCC)([C@]([C@@]1(C)[H])(C=C)[H])[H])=O
SPLASH splash10-014i-9000000000-35dcec84cb0d7d73bc14
Source of Spectrum C-113-4229-72
Synonyms (3S,4S,5S)-3-methyl-5-tridecyl-4-vinyldihydro-2(3H)-furanone (3S,4S,5S)-4-ethenyl-3-methyl-5-tridecyl-2-oxolanone (3S,4S,5S)-4-ethenyl-3-methyl-5-tridecyloxolan-2-one (3S,4S,5S)-4-ethenyl-3-methyl-5-tridecyl-oxolan-2-one
Wiley ID 1310283