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Methyl R-(+)-2-Formyl-2-(phenylthio)hexanoate
SpectraBase Compound ID 6QXFvYafyTU
InChI InChI=1S/C14H18O3S/c1-3-4-10-14(11-15,13(16)17-2)18-12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3/t14-/m1/s1
InChIKey SXLWDJWSKIKFGP-CQSZACIVSA-N
Mol Weight 266.35 g/mol
Molecular Formula C14H18O3S
Exact Mass 266.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLdm4Swvd3V
Name Methyl R-(+)-2-Formyl-2-(phenylthio)hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-3-4-10-14(11-15,13(16)17-2)18-12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3/t14-/m1/s1
InChIKey SXLWDJWSKIKFGP-CQSZACIVSA-N
Molecular Weight 266.355 g/mol
SMILES [C@](C(=O)OC)(Sc1ccccc1)(C=O)CCCC
SPLASH splash10-0a4r-2980000000-dfe8f50a8f72b2108696
Source of Spectrum K-127-1716-12
Synonyms Methyl (2R)-2-formyl-2-(phenylsulfanyl)hexanoate
Wiley ID 1269827