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1-(BUT-3-ENYL)-4-ENDO-ISOPROPYL-7-METHYL-4-EXO-(2,2,2-TRIFLUOROETHOXY)-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
SpectraBase Compound ID 272JNM0dBKU
InChI InChI=1S/C17H23F3O3/c1-5-6-7-15-9-13(21)17(11(2)3,22-10-16(18,19)20)14(23-15)8-12(15)4/h5,8,11,14H,1,6-7,9-10H2,2-4H3/t14-,15-,17+/m0/s1
InChIKey YXMZOSRRZPLSFO-YQQAZPJKSA-N
Mol Weight 332.36 g/mol
Molecular Formula C17H23F3O3
Exact Mass 332.159929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcsF1wz8m9Z
Name (1S,2S,5S)-5-but-3-enyl-2-isopropyl-6-methyl-2-(2,2,2-trifluoroethoxy)-8-oxabicyclo[3.2.1]oct-6-en-3-one
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Formula C17H23F3O3
InChI InChI=1S/C17H23F3O3/c1-5-6-7-15-9-13(21)17(11(2)3,22-10-16(18,19)20)14(23-15)8-12(15)4/h5,8,11,14H,1,6-7,9-10H2,2-4H3/t14-,15-,17+/m0/s1
InChIKey YXMZOSRRZPLSFO-YQQAZPJKSA-N
Molecular Weight 332.363 g/mol
SMILES [C@]1([C@]2(O[C@](CC1=O)(CCC=C)C(=C2)C)[H])(OCC(F)(F)F)C(C)C
SPLASH splash10-0081-7933000000-843a63ccd309739c84b6
Source of Spectrum K1-0-2170-24
Synonyms (1S,2S,5S)-5-but-3-enyl-6-methyl-2-propan-2-yl-2-(2,2,2-trifluoroethoxy)-8-oxabicyclo[3.2.1]oct-6-en-3-one (1S,2S,5S)-5-but-3-enyl-6-methyl-2-propan-2-yl-2-[2,2,2-tris(fluoranyl)ethoxy]-8-oxabicyclo[3.2.1]oct-6-en-3-one
Wiley ID 1588806