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(1S*,2S*,6R*)-6-(5-phenylpent-4-ynyl)-7-oxabicyclo[4.1.0]heptan-2-ol
SpectraBase Compound ID 3dqXjDupLhY
InChI InChI=1S/C17H20O2/c18-15-11-7-13-17(16(15)19-17)12-6-2-5-10-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,18H,2,6-7,11-13H2/t15-,16-,17+/m0/s1
InChIKey KKXLOKLECISORW-YESZJQIVSA-N
Mol Weight 256.34 g/mol
Molecular Formula C17H20O2
Exact Mass 256.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfmglVIv6cc
Name (1S*,2S*,6R*)-6-(5-phenylpent-4-ynyl)-7-oxabicyclo[4.1.0]heptan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O2
InChI InChI=1S/C17H20O2/c18-15-11-7-13-17(16(15)19-17)12-6-2-5-10-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,18H,2,6-7,11-13H2/t15-,16-,17+/m0/s1
InChIKey KKXLOKLECISORW-YESZJQIVSA-N
Literature Reference DOI 10.1021/jo5023266
Molecular Weight 256.345 g/mol
SMILES O[C@]1(CCC[C@@]2([C@]1(O2)[H])CCCC#Cc1ccccc1)[H]
SPLASH splash10-00or-0930000000-0fa3f16b96d04d30e6bd
Source of Spectrum J-79-11806-1a
Synonyms (1S,2S,6R)-6-(5-phenylpent-4-yn-1-yl)-7-oxabicyclo[4.1.0]heptan-2-ol
Wiley ID 1755845