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TANPARTHIN-ALPHA-PEROXIDE
SpectraBase Compound ID 91ZMFvEpgYs
InChI InChI=1S/C15H18O5/c1-8-9-4-5-14(3,17)15-7-6-13(2,19-20-15)11(15)10(9)18-12(8)16/h6-7,9-11,17H,1,4-5H2,2-3H3/t9-,10-,11-,13+,14+,15-/m0/s1
InChIKey ZTOKBJPHHAIUKE-HFSUPIEXSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B912lwCUJ7E
Name Tanaparthin-.alpha.-peroxide
Alternate Name(s) (1S,2R,5S,9S,10S,11R)-2-hydroxy-2,11-dimethyl-6-methylene-8,12,13-trioxatetracyclo[9.2.2.0(1,10).0(5,9)]pentadec-14-en-7-one
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Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-8-9-4-5-14(3,17)15-7-6-13(2,19-20-15)11(15)10(9)18-12(8)16/h6-7,9-11,17H,1,4-5H2,2-3H3/t9-,10-,11-,13+,14+,15-/m0/s1
InChIKey ZTOKBJPHHAIUKE-HFSUPIEXSA-N
Molecular Weight 278.304 g/mol
SMILES O[C@]1([C@@]23[C@@]([C@]4(OC(=O)C([C@@]4(CC1)[H])=C)[H])([C@@](C)(C=C2)OO3)[H])C
SPLASH splash10-03di-0930000000-af3876268ab379de85eb
Source of Spectrum KC-0-1983-12
Wiley ID 786218