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(+-)-(2RS,4aRS,9aSR)-4a-(but-3-enyl)-2-phenyl-4,4a,5,6,7,8,9,9a-octahydrocyclohepta-1,3-dioxine
SpectraBase Compound ID BDyy2L30b6P
InChI InChI=1S/C19H26O2/c1-2-3-13-19-14-9-5-8-12-17(19)21-18(20-15-19)16-10-6-4-7-11-16/h2,4,6-7,10-11,17-18H,1,3,5,8-9,12-15H2/t17-,18+,19-/m0/s1
InChIKey JAXRJOBCMCYFLO-OTWHNJEPSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LGCCJl04Sk
Name (+-)-(2RS,4aRS,9aSR)-4a-(but-3-enyl)-2-phenyl-4,4a,5,6,7,8,9,9a-octahydrocyclohepta-1,3-dioxine
Alternate Name(s) 4a-(3-butenyl)-2-phenyloctahydrocyclohepta[d][1,3]dioxin (2R,4aR,9aS)-4a-but-3-enyl-2-phenyl-5,6,7,8,9,9a-hexahydro-4H-cyclohepta[d][1,3]dioxine
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Formula C19H26O2
InChI InChI=1S/C19H26O2/c1-2-3-13-19-14-9-5-8-12-17(19)21-18(20-15-19)16-10-6-4-7-11-16/h2,4,6-7,10-11,17-18H,1,3,5,8-9,12-15H2/t17-,18+,19-/m0/s1
InChIKey JAXRJOBCMCYFLO-OTWHNJEPSA-N
Molecular Weight 286.415 g/mol
SMILES [C@]1(O[C@@]2([C@](CO1)(CCCCC2)CCC=C)[H])(c1ccccc1)[H]
SPLASH splash10-0arr-9300000000-865bb7fe5f6ebe782d07
Source of Spectrum J-63-3146-32
Wiley ID 1290309