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N-(2-[(4-Methoxyphenyl)sulfanyl]ethyl)propanamide
SpectraBase Compound ID IJrRPInANT2
InChI InChI=1S/C12H17NO2S/c1-3-12(14)13-8-9-16-11-6-4-10(15-2)5-7-11/h4-7H,3,8-9H2,1-2H3,(H,13,14)
InChIKey VBINOQCKAFUAEL-UHFFFAOYSA-N
Mol Weight 239.33 g/mol
Molecular Formula C12H17NO2S
Exact Mass 239.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5SCbIMnbxK
Name N-(2-[(4-Methoxyphenyl)sulfanyl]ethyl)propanamide
CAS Registry Number 82772-77-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO2S
InChI InChI=1S/C12H17NO2S/c1-3-12(14)13-8-9-16-11-6-4-10(15-2)5-7-11/h4-7H,3,8-9H2,1-2H3,(H,13,14)
InChIKey VBINOQCKAFUAEL-UHFFFAOYSA-N
Molecular Weight 239.333 g/mol
SMILES N(CCSc1ccc(cc1)OC)C(CC)=O
SPLASH splash10-0gb9-3900000000-00a67130ca6004103ec5
Source of Spectrum W5-1989-35600-29936
Synonyms N-[2-[(4-methoxyphenyl)thio]ethyl]propanamide N-[2-[(4-methoxyphenyl)thio]ethyl]propionamide
Wiley ID 1241810