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(1R,1'S,4R,6'R,9'R)-4,9'-bis(prop-1-en-2-yl)-2',11'-dioxaspiro[cyclohexane-1,3'-tricyclo[4.4.1.0(1,6)]undecan]-2-one
SpectraBase Compound ID IL0rKuaxsa9
InChI InChI=1S/C20H28O3/c1-13(2)15-5-7-18(17(21)11-15)9-10-19-8-6-16(14(3)4)12-20(19,22-18)23-19/h15-16H,1,3,5-12H2,2,4H3/t15-,16-,18-,19-,20-/m1/s1
InChIKey GLANEDBBHQGARE-YKXHTNLXSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30hwy8NMMC
Name (1R,1'S,4R,6'R,9'R)-4,9'-bis(prop-1-en-2-yl)-2',11'-dioxaspiro[cyclohexane-1,3'-tricyclo[4.4.1.0(1,6)]undecan]-2-one
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Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-13(2)15-5-7-18(17(21)11-15)9-10-19-8-6-16(14(3)4)12-20(19,22-18)23-19/h15-16H,1,3,5-12H2,2,4H3/t15-,16-,18-,19-,20-/m1/s1
InChIKey GLANEDBBHQGARE-YKXHTNLXSA-N
Instrument Name Agilent 6865 GC /5973
Ionization Type EI
Literature Reference DOI 10.1021/np030338h
Molecular Weight 316.441 g/mol
SMILES C1[C@@](C(C)=C)(C[C@@]23O[C@@]4(CC[C@]3(O2)C1)CC[C@@](C(C)=C)(CC4=O)[H])[H]
SPLASH splash10-0avs-6901000000-9ee341984d9e6ecf17b5
Source of Spectrum G4-67-701-6
Wiley ID 1881704