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(R,R)-(2,2-Dimethyl-1,3-dioxolane-4,5-diyl)bis(cyclohex-1-en-1-ylmethanone)
SpectraBase Compound ID B3HegXFhU7c
InChI InChI=1S/C19H26O4/c1-19(2)22-17(15(20)13-9-5-3-6-10-13)18(23-19)16(21)14-11-7-4-8-12-14/h9,11,17-18H,3-8,10,12H2,1-2H3/t17-,18-/m0/s1
InChIKey HSZNJNCSHWINPR-ROUUACIJSA-N
Mol Weight 318.41 g/mol
Molecular Formula C19H26O4
Exact Mass 318.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKDZgycTz22
Name (R,R)-(2,2-Dimethyl-1,3-dioxolane-4,5-diyl)bis(cyclohex-1-en-1-ylmethanone)
Appearance Colorless oil
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Exact Mass 318.183109313 u
Formula C19H26O4
InChI InChI=1S/C19H26O4/c1-19(2)22-17(15(20)13-9-5-3-6-10-13)18(23-19)16(21)14-11-7-4-8-12-14/h9,11,17-18H,3-8,10,12H2,1-2H3/t17-,18-/m0/s1
InChIKey HSZNJNCSHWINPR-ROUUACIJSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901043
Molecular Weight 318.413 g/mol
Optical Rotation [a]D25 = -43.0 (c = 0.35, CHCl3)
Quality 155
Reported Formula C19H26O4
SMILES C1(O[C@]([C@@](O1)(C(=O)C1=CCCCC1)[H])(C(=O)C1=CCCCC1)[H])(C)C
SPLASH splash10-0a4i-3920000000-8aa4d4f2bb470ad963f0
Source of Spectrum K1-2019-6258-5g (DOI: 10.1002/ejoc.201901043)
Thin-Layer Chromatography 0.2 (n-pentane/EtOAc, 10:1)
Wiley ID 1892238