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(1R*,5R*,6S*)-5-benzyl-3,11-dioxatricyclo[4.3.2.0(1,6)]undecan-4-one
SpectraBase Compound ID 54o3spgVJ3s
InChI InChI=1S/C16H18O3/c17-14-13(9-12-5-2-1-3-6-12)16-8-4-7-15(16,10-18-14)11-19-16/h1-3,5-6,13H,4,7-11H2/t13-,15-,16-/m0/s1
InChIKey OKDYAZNCRGPJNE-BPUTZDHNSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CXqeQQBGlI
Name (1R*,5R*,6S*)-5-benzyl-3,11-dioxatricyclo[4.3.2.0(1,6)]undecan-4-one
Alternate Name(s) (1R,5R,6S)-5-benzyl-3,11-dioxatricyclo[4.3.2.0(1,6)]undecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c17-14-13(9-12-5-2-1-3-6-12)16-8-4-7-15(16,10-18-14)11-19-16/h1-3,5-6,13H,4,7-11H2/t13-,15-,16-/m0/s1
InChIKey OKDYAZNCRGPJNE-BPUTZDHNSA-N
Molecular Weight 258.317 g/mol
SMILES [C@@]123[C@](C(=O)OC[C@@]3(CCC1)CO2)(Cc1ccccc1)[H]
SPLASH splash10-0006-9140000000-316a2e402566bdb698de
Source of Spectrum KC-1991-1553-20
Wiley ID 1262072