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(E)-4-Butyl-4-phenylthio-5-hepten-3-one
SpectraBase Compound ID IBSUwCtiOhP
InChI InChI=1S/C17H24OS/c1-4-7-14-17(13-5-2,16(18)6-3)19-15-11-9-8-10-12-15/h5,8-13H,4,6-7,14H2,1-3H3/b13-5+
InChIKey VXHPKTFNIJWBNE-WLRTZDKTSA-N
Mol Weight 276.44 g/mol
Molecular Formula C17H24OS
Exact Mass 276.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID U4UXrhqPqM
Name (E)-4-Butyl-4-phenylthio-5-hepten-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24OS
InChI InChI=1S/C17H24OS/c1-4-7-14-17(13-5-2,16(18)6-3)19-15-11-9-8-10-12-15/h5,8-13H,4,6-7,14H2,1-3H3/b13-5+
InChIKey VXHPKTFNIJWBNE-WLRTZDKTSA-N
Molecular Weight 276.438 g/mol
SMILES C(Sc1ccccc1)(C(=O)CC)(\C=C\C)CCCC
SPLASH splash10-014i-0690000000-39eda4bc7ca5228f2d2e
Source of Spectrum AJ-65-2971-5
Synonyms (5E)-4-butyl-4-(phenylsulfanyl)-5-hepten-3-one
Wiley ID 771779