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(1aSR,2RS,3RS,3aRS,5SR,6aRS,6bRS)-5-(n-Butyl)-octahydro-6a-(hydroxymethyl)-2-methyl-7-oxabicyclo[4.1.0]hept-1(6)-eno[3,2-b]furan-3-ol

View entire compound with spectra: 1 MS (GC)

(1aSR,2RS,3RS,3aRS,5SR,6aRS,6bRS)-5-(n-Butyl)-octahydro-6a-(hydroxymethyl)-2-methyl-7-oxabicyclo[4.1.0]hept-1(6)-eno[3,2-b]furan-3-ol
SpectraBase Compound ID 7B2w1WPjZMw
InChI InChI=1S/C14H24O4/c1-3-4-5-9-6-14(7-15)12(17-9)10(16)8(2)11-13(14)18-11/h8-13,15-16H,3-7H2,1-2H3/t8-,9+,10-,11+,12+,13+,14-/m1/s1
InChIKey FTYPEYVGLKOFTB-MLVXWEHQSA-N
Mol Weight 256.34 g/mol
Molecular Formula C14H24O4
Exact Mass 256.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErNuEff3fBm
Name (1aSR,2RS,3RS,3aRS,5SR,6aRS,6bRS)-5-(n-Butyl)-octahydro-6a-(hydroxymethyl)-2-methyl-7-oxabicyclo[4.1.0]hept-1(6)-eno[3,2-b]furan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O4
InChI InChI=1S/C14H24O4/c1-3-4-5-9-6-14(7-15)12(17-9)10(16)8(2)11-13(14)18-11/h8-13,15-16H,3-7H2,1-2H3/t8-,9+,10-,11+,12+,13+,14-/m1/s1
InChIKey FTYPEYVGLKOFTB-MLVXWEHQSA-N
Molecular Weight 256.342 g/mol
SMILES O[C@@]1([C@]([C@]2([C@@]([C@]3(CO)[C@]1(O[C@](C3)(CCCC)[H])[H])(O2)[H])[H])(C)[H])[H]
SPLASH splash10-006y-2900000000-4ae2c1a213796c0bf06a
Source of Spectrum F5-6-4433-12
Synonyms (1aSR,2RS,3RS,3aRS,5SR,6aRS,6bRS)-5-(t-Butyl)-octahydro-6a-(hydroxymethyl)-2-methyl-7-oxabicyclo[4.1.0]hept-1(6)-eno[3,2-b]furan-3-ol (1aS,2R,3R,3aR,5S,6aR,6bR)-5-butyl-6a-(hydroxymethyl)-2-methyloctahydrooxireno[2,3-e]benzofuran-3-ol (1aS,2R,3R,3aR,5S,6aR,6bR)-5-butyl-6a-(hydroxymethyl)-2-methyl-2,3,3a,5,6,6b-hexahydro-1aH-oxireno[2,3-e]benzofuran-3-ol (1aS,2R,3R,3aR,5S,6aR,6bR)-5-butyl-6a-(hydroxymethyl)-2-methyl-2,3,3a,5,6,6b-hexahydro-1aH-oxireno[2,3-e][1]benzofuran-3-ol
Wiley ID 1733728