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1,3-Dithiolane-2-acetic acid, 2-methyl-, methyl ester
SpectraBase Compound ID IUdv1LEmjxE
InChI InChI=1S/C7H12O2S2/c1-7(5-6(8)9-2)10-3-4-11-7/h3-5H2,1-2H3
InChIKey KIOUEQHNRVBGAQ-UHFFFAOYSA-N
Mol Weight 192.29 g/mol
Molecular Formula C7H12O2S2
Exact Mass 192.027872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIMUquDgTVK
Name 1,3-Dithiolane-2-acetic acid, 2-methyl-, methyl ester
Alternate Name(s) Methyl (2-methyl-1,3-dithiolan-2-yl)acetate 2-(2-Methyl-1,3-dithiolan-2-yl)acetic acid methyl ester Methyl 2-(2-methyl-1,3-dithiolan-2-yl)acetate Methyl 2-(2-methyl-1,3-dithiolan-2-yl)ethanoate
CAS Registry Number 65726-45-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2S2
InChI InChI=1S/C7H12O2S2/c1-7(5-6(8)9-2)10-3-4-11-7/h3-5H2,1-2H3
InChIKey KIOUEQHNRVBGAQ-UHFFFAOYSA-N
Molecular Weight 192.291 g/mol
SMILES C1SC(SC1)(C)CC(OC)=O
SPLASH splash10-02u3-4900000000-11b3ceab4a385cdb6c10
Source of Spectrum O-22-80-8
Wiley ID 1187901