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2,2-Dimethylpropionic acid, 5-acetylthio-3-hydroxypentyl ester
SpectraBase Compound ID 1kqL1sDEecg
InChI InChI=1S/C12H22O4S/c1-9(13)17-8-6-10(14)5-7-16-11(15)12(2,3)4/h10,14H,5-8H2,1-4H3
InChIKey LTDROGUFMKUICV-UHFFFAOYSA-N
Mol Weight 262.36 g/mol
Molecular Formula C12H22O4S
Exact Mass 262.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 705bPQ69R7P
Name 2,2-DIMETHYLPROPIONIC ACID, 5-ACETYLSULFANYL-3-HYDROXYPENTYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O4S
InChI InChI=1S/C12H22O4S/c1-9(13)17-8-6-10(14)5-7-16-11(15)12(2,3)4/h10,14H,5-8H2,1-4H3
InChIKey LTDROGUFMKUICV-UHFFFAOYSA-N
Molecular Weight 262.1233
SMILES OC(CCSC(C)=O)CCOC(=O)C(C)(C)C
SPLASH splash10-052f-9200000000-f1710755192367758fad
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany