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(2R)-2-Benzyl-1-(thien-2'-yl)hexan-1-one
SpectraBase Compound ID HF3MC6e1LuV
InChI InChI=1S/C17H20OS/c1-2-3-10-15(13-14-8-5-4-6-9-14)17(18)16-11-7-12-19-16/h4-9,11-12,15H,2-3,10,13H2,1H3/t15-/m1/s1
InChIKey WRAWVOBFZYGBCD-OAHLLOKOSA-N
Mol Weight 272.41 g/mol
Molecular Formula C17H20OS
Exact Mass 272.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7n9ASlJKmvq
Name (2R)-2-Benzyl-1-(thien-2'-yl)hexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20OS
InChI InChI=1S/C17H20OS/c1-2-3-10-15(13-14-8-5-4-6-9-14)17(18)16-11-7-12-19-16/h4-9,11-12,15H,2-3,10,13H2,1H3/t15-/m1/s1
InChIKey WRAWVOBFZYGBCD-OAHLLOKOSA-N
Molecular Weight 272.406 g/mol
SMILES c1(C([C@@](Cc2ccccc2)(CCCC)[H])=O)sccc1
SPLASH splash10-02us-9460000000-3e98718d58cfc52c3b68
Source of Spectrum F-69-797-11
Synonyms (2R)-2-benzyl-1-(2-thienyl)-1-hexanone
Wiley ID 1594577