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(1R,2R,5R)-2-((R)-1-Hydroxy-3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one

View entire compound with spectra: 3 MS (GC)

(1R,2R,5R)-2-((R)-1-Hydroxy-3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one
SpectraBase Compound ID EvJyJZT4bBD
InChI InChI=1S/C16H18O3/c17-13(8-6-11-4-2-1-3-5-11)16-14(18)10-12-7-9-15(16)19-12/h1-5,7,9,12-13,15-17H,6,8,10H2/t12-,13+,15-,16+/m0/s1
InChIKey STLMXGGIOJDWJD-LQKXBSAESA-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 AdnJw5rnpiP
Name (1R,2S,5R)-2-((R)-1-Hydroxy-3-phenylpropyl)-8-oxabicyclo-[3.2.1]oct-6-en-3-one
Alternate Name(s) (1R,2S,5R)-2-((R)-1-hydroxy-3-phenylpropyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c17-13(8-6-11-4-2-1-3-5-11)16-14(18)10-12-7-9-15(16)19-12/h1-5,7,9,12-13,15-17H,6,8,10H2/t12-,13+,15-,16+/m0/s1
InChIKey STLMXGGIOJDWJD-LQKXBSAESA-N
Literature Reference DOI 10.1002/ajoc.201200038
Molecular Weight 258.317 g/mol
SMILES O[C@](CCc1ccccc1)([C@]1([C@]2(O[C@@](CC1=O)([H])C=C2)[H])[H])[H]
SPLASH splash10-0006-9800000000-44aacfe50878c2da2cd8
Source of Spectrum AJO-1-30/SM33-alpha_5db
Wiley ID 1769883