N-(2-[(4-Methoxyphenyl)sulfanyl]ethyl)alanine

SpectraBase Compound ID	GoSC3fdPVpY
InChI	InChI=1S/C12H17NO3S/c1-9(12(14)15)13-7-8-17-11-5-3-10(16-2)4-6-11/h3-6,9,13H,7-8H2,1-2H3,(H,14,15)
InChIKey	WEJTUTIUWRANSN-UHFFFAOYSA-N Google Search
Mol Weight	255.33 g/mol
Molecular Formula	C12H17NO3S
Exact Mass	255.092915 g/mol

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SpectraBase Spectrum ID	FeC8ZRjs864
Name	N-(2-[(4-Methoxyphenyl)sulfanyl]ethyl)alanine
Alternate Name(s)	2-[2-(4-methoxyphenyl)sulfanylethylamino]propanoic acid 2-[2-[(4-methoxyphenyl)thio]ethylamino]propanoic acid 2-[2-[(4-methoxyphenyl)thio]ethylamino]propionic acid N-[2-(4-Methoxyphenylthio)ethyl]alanine
CAS Registry Number	64276-43-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H17NO3S
InChI	InChI=1S/C12H17NO3S/c1-9(12(14)15)13-7-8-17-11-5-3-10(16-2)4-6-11/h3-6,9,13H,7-8H2,1-2H3,(H,14,15)
InChIKey	WEJTUTIUWRANSN-UHFFFAOYSA-N
Molecular Weight	255.332 g/mol
SMILES	OC(C(C)NCCSc1ccc(cc1)OC)=O
SPLASH	splash10-0zfr-8900000000-5485bd262c67620ff9b0
Source of Spectrum	W5-1989-35598-29938
Wiley ID	1258677