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(4Z)-5-butyl-4-(3-phenylpropylidene)-1,3-oxathiolan-2-one
SpectraBase Compound ID 8Gxm5MTS9ed
InChI InChI=1S/C16H20O2S/c1-2-3-11-14-15(19-16(17)18-14)12-7-10-13-8-5-4-6-9-13/h4-6,8-9,12,14H,2-3,7,10-11H2,1H3/b15-12-
InChIKey LVCIIEDKFQQYFE-QINSGFPZSA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ufyaYFa407
Name (4Z)-5-butyl-4-(3-phenylpropylidene)-1,3-oxathiolan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-2-3-11-14-15(19-16(17)18-14)12-7-10-13-8-5-4-6-9-13/h4-6,8-9,12,14H,2-3,7,10-11H2,1H3/b15-12-
InChIKey LVCIIEDKFQQYFE-QINSGFPZSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701813
Molecular Weight 276.394 g/mol
Quality 278
Reported Formula C16H20O2S
SMILES C1(\C(SC(O1)=O)=C\CCC1=CC=CC=C1)CCCC
SPLASH splash10-004j-6690000000-bb791fc39eaacc681c90
Source of Spectrum K1-2018-SM4-4-3 (DOI: 10.1002/ejoc.201701813)
Wiley ID 1891563