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2-methyl-4-p-ethoxyphenylbutyric acid methyl thioester
SpectraBase Compound ID 5aeGkp8xAm9
InChI InChI=1S/C14H20O2S/c1-4-16-13-9-7-12(8-10-13)6-5-11(2)14(15)17-3/h7-11H,4-6H2,1-3H3
InChIKey VCIAZYNKZCAKGL-UHFFFAOYSA-N
Mol Weight 252.37 g/mol
Molecular Formula C14H20O2S
Exact Mass 252.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4A72yxfWAi
Name 2-methyl-4-p-ethoxyphenylbutyric acid methyl thioester
Appearance Colorless liquid
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Exact Mass 252.118401056 u
Formula C14H20O2S
InChI InChI=1S/C14H20O2S/c1-4-16-13-9-7-12(8-10-13)6-5-11(2)14(15)17-3/h7-11H,4-6H2,1-3H3
InChIKey VCIAZYNKZCAKGL-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 252.372 g/mol
Quality 140
Reported Formula C14H20O2S
SMILES C1=CC(=CC=C1OCC)CCC(C)C(=O)SC
SPLASH splash10-0a4j-0920000000-ba5992b4f70782eeece2
Source of Spectrum CN113511991B
Wiley ID 1894826