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2-[4-(ethylthio)phenyl]-2-hydroxy-malonic acid diisopropyl ester
SpectraBase Compound ID YxSx8Wujd7
InChI InChI=1S/C17H24O5S/c1-6-23-14-9-7-13(8-10-14)17(20,15(18)21-11(2)3)16(19)22-12(4)5/h7-12,20H,6H2,1-5H3
InChIKey QWBDEJXHWHIEFR-UHFFFAOYSA-N
Mol Weight 340.43 g/mol
Molecular Formula C17H24O5S
Exact Mass 340.134445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BO15IGP2ph
Name MALONIC ACID, 2-(4-ETHYLTHIOPHENYL)-2-HYDROXY-, DIISOPROPYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H24O5S
InChI InChI=1S/C17H24O5S/c1-6-23-14-9-7-13(8-10-14)17(20,15(18)21-11(2)3)16(19)22-12(4)5/h7-12,20H,6H2,1-5H3
InChIKey QWBDEJXHWHIEFR-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 340.1338
SMILES OC(c1ccc(SCC)cc1)(C(OC(C)C)=O)C(=O)OC(C)C
SPLASH splash10-0i00-4981000000-6f19217e5b5566348165
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany