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3-Methoxybenzenecarbothioic acid S-ethyl ester
SpectraBase Compound ID GCpPZAgxLSW
InChI InChI=1S/C10H12O2S/c1-3-13-10(11)8-5-4-6-9(7-8)12-2/h4-7H,3H2,1-2H3
InChIKey LDONEEGFXCQEIC-UHFFFAOYSA-N
Mol Weight 196.26 g/mol
Molecular Formula C10H12O2S
Exact Mass 196.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QjZOGaXZca
Name 3-Methoxybenzenecarbothioic acid S-ethyl ester
Alternate Name(s) 3-Methoxythiobenzoic acid S-ethyl ester S-ethyl 3-methoxybenzenecarbothioate
CAS Registry Number 28145-59-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2S
InChI InChI=1S/C10H12O2S/c1-3-13-10(11)8-5-4-6-9(7-8)12-2/h4-7H,3H2,1-2H3
InChIKey LDONEEGFXCQEIC-UHFFFAOYSA-N
Molecular Weight 196.264 g/mol
SMILES C(c1cc(OC)ccc1)(=O)SCC
SPLASH splash10-0a4i-1900000000-0db43de5a20fd571b68a
Source of Spectrum O-3-2624-0
Wiley ID 1192700