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3-(2-Methyl-1,3-dithiolan-2-yl)propanoic acid ethyl ester

View entire compound with spectra: 3 MS (GC)

3-(2-Methyl-1,3-dithiolan-2-yl)propanoic acid ethyl ester
SpectraBase Compound ID 8BIjc9Or8qU
InChI InChI=1S/C9H16O2S2/c1-3-11-8(10)4-5-9(2)12-6-7-13-9/h3-7H2,1-2H3
InChIKey PWBJBLZEXGHASH-UHFFFAOYSA-N
Mol Weight 220.34 g/mol
Molecular Formula C9H16O2S2
Exact Mass 220.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JmN6KM1vpb
Name 3-(2-Methyl-1,3-dithiolan-2-yl)propanoic acid ethyl ester
CAS Registry Number 141630-41-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2S2
InChI InChI=1S/C9H16O2S2/c1-3-11-8(10)4-5-9(2)12-6-7-13-9/h3-7H2,1-2H3
InChIKey PWBJBLZEXGHASH-UHFFFAOYSA-N
Molecular Weight 220.345 g/mol
SMILES C(=O)(CCC1(SCCS1)C)OCC
SPLASH splash10-014i-5900000000-5b501201c92344988901
Synonyms 3-(2-Methyl-1,3-dithiolan-2-yl)propionic acid ethyl ester Ethyl 3-(2-methyl-1,3-dithiolan-2-yl)propanoate
Wiley ID 1484786