Propanoic acid, 3-[(2-nitrophenyl)sulfinyl]-

SpectraBase Compound ID	9PTK61d9FPf
InChI	InChI=1S/C9H9NO5S/c11-9(12)5-6-16(15)8-4-2-1-3-7(8)10(13)14/h1-4H,5-6H2,(H,11,12)
InChIKey	DESANEVNTFEVGL-UHFFFAOYSA-N Google Search
Mol Weight	243.23 g/mol
Molecular Formula	C9H9NO5S
Exact Mass	243.020144 g/mol

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SpectraBase Spectrum ID	BE9tYKOl5WZ
Name	Propanoic acid, 3-[(2-nitrophenyl)sulfinyl]-
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C9H9NO5S
InChI	InChI=1S/C9H9NO5S/c11-9(12)5-6-16(15)8-4-2-1-3-7(8)10(13)14/h1-4H,5-6H2,(H,11,12)
InChIKey	DESANEVNTFEVGL-UHFFFAOYSA-N
Molecular Weight	243.233 g/mol
SMILES	OC(=O)CCS(=O)c1ccccc1[N+]([O-])=O
SPLASH	splash10-0kdi-9100000000-7e4eea6ba0ab63058de5
Source of Spectrum	JX-2015-1-381
Synonyms	3-((2-Nitrophenyl)sulfinyl)propanoic acid 3-[(2-Nitrophenyl)sulfinyl]propanoic acid 3-(2-Nitrophenyl)sulfinylpropanoic acid
Wiley ID	1721216