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Benzenesulfonic acid, 4-nitro-, ethyl ester
SpectraBase Compound ID APsin5d1Geh
InChI InChI=1S/C8H9NO5S/c1-2-14-15(12,13)8-5-3-7(4-6-8)9(10)11/h3-6H,2H2,1H3
InChIKey MHGHMVLMYWTSMK-UHFFFAOYSA-N
Mol Weight 231.22 g/mol
Molecular Formula C8H9NO5S
Exact Mass 231.020144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBox8zjwwvI
Name Benzenesulfonic acid, 4-nitro-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9NO5S
InChI InChI=1S/C8H9NO5S/c1-2-14-15(12,13)8-5-3-7(4-6-8)9(10)11/h3-6H,2H2,1H3
InChIKey MHGHMVLMYWTSMK-UHFFFAOYSA-N
Molecular Weight 231.222 g/mol
SMILES CCOS(=O)(=O)c1ccc(cc1)[N+]([O-])=O
SPLASH splash10-009i-9820000000-2e09068d4d1853de87c1
Source of Spectrum JX-2015-0-901
Synonyms Ethyl 4-nitrobenzenesulfonate
Wiley ID 1720776