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(2S)-2-Benzyl-1-(thien-2'-yl)pent-4-en-1-one
SpectraBase Compound ID FQnonqNffaQ
InChI InChI=1S/C16H16OS/c1-2-7-14(12-13-8-4-3-5-9-13)16(17)15-10-6-11-18-15/h2-6,8-11,14H,1,7,12H2/t14-/m0/s1
InChIKey IBFLVHQEFLFGKQ-AWEZNQCLSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76CFqzdJgfL
Name (2S)-2-Benzyl-1-(thien-2'-yl)pent-4-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-2-7-14(12-13-8-4-3-5-9-13)16(17)15-10-6-11-18-15/h2-6,8-11,14H,1,7,12H2/t14-/m0/s1
InChIKey IBFLVHQEFLFGKQ-AWEZNQCLSA-N
Molecular Weight 256.363 g/mol
SMILES c1(C([C@](Cc2ccccc2)(CC=C)[H])=O)sccc1
SPLASH splash10-02u0-3590000000-7bbdb6517b7bf269db83
Source of Spectrum F-69-799-11
Synonyms (2S)-2-benzyl-1-(2-thienyl)-4-penten-1-one
Wiley ID 1594567