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(2S,4S,5S)-4-Acetyl-2-phenyl-5-(2-propenyl)-1,3-dioxacyclohexane
SpectraBase Compound ID 945K2DkwZJS
InChI InChI=1S/C15H18O3/c1-3-7-13-10-17-15(18-14(13)11(2)16)12-8-5-4-6-9-12/h3-6,8-9,13-15H,1,7,10H2,2H3/t13-,14-,15+/m1/s1
InChIKey BVIVYYSOVZMAQO-KFWWJZLASA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 253D8JX1Gq
Name (2S,4S,5S)-4-Acetyl-2-phenyl-5-(2-propenyl)-1,3-dioxacyclohexane
Alternate Name(s) (2S,4S,5R)-4-Acetyl-2-phenyl-5-(2-propenyl)-1,3-dioxacyclohexane 4-Allyl-3,5-O-benzylidene-1,4-dideoxy-L-ribulose
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Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-7-13-10-17-15(18-14(13)11(2)16)12-8-5-4-6-9-12/h3-6,8-9,13-15H,1,7,10H2,2H3/t13-,14-,15+/m1/s1
InChIKey BVIVYYSOVZMAQO-KFWWJZLASA-N
Molecular Weight 246.306 g/mol
SMILES [C@@]1(O[C@@]([C@@](CO1)(CC=C)[H])(C(=O)C)[H])(c1ccccc1)[H]
SPLASH splash10-054o-9200000000-a1343216284ca2e093a0
Source of Spectrum QC-7-3378-11
Wiley ID 869609