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ETHYLTHIOPHENYLCETONE
SpectraBase Compound ID 9IIcsevX477
InChI InChI=1S/C9H10OS/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey XZJPOQGUMFRLEW-UHFFFAOYSA-N
Mol Weight 166.24 g/mol
Molecular Formula C9H10OS
Exact Mass 166.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zyZqXtj0Wk
Name Benzenecarbothioic acid, S-ethyl ester
Alternate Name(s) S-Ethyl benzenecarbothioate benzenecarbothioic acid S-ethyl ester Benzoic acid, thio-, S-ethyl ester S-Ethyl thiobenzoate Thiobenzoic acid S-ethyl ester
CAS Registry Number 1484-17-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10OS
InChI InChI=1S/C9H10OS/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey XZJPOQGUMFRLEW-UHFFFAOYSA-N
Molecular Weight 166.238 g/mol
SMILES CCSC(c1ccccc1)=O
SPLASH splash10-0a4i-0900000000-ecaf6ee86b199beed04d
Source of Spectrum KC-0-3347-7
Wiley ID 826748