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Ethyl 2-((4-methylbenzyl)thio)acetate
SpectraBase Compound ID 8nHHtAXCU2D
InChI InChI=1S/C12H16O2S/c1-3-14-12(13)9-15-8-11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3
InChIKey PBSSYSNVKZYEAB-UHFFFAOYSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1R20vncbFA
Name Ethyl 2-((4-methylbenzyl)thio)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-3-14-12(13)9-15-8-11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3
InChIKey PBSSYSNVKZYEAB-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Molecular Weight 224.318 g/mol
SMILES C(C)OC(CSCc1ccc(cc1)C)=O
SPLASH splash10-0a4i-0900000000-3b3b751b5b26d5ba4273
Source of Spectrum WO2016086015A1
Wiley ID 1853247