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2,4-Dimethoxy-3-methyl-5-nitrophenol
SpectraBase Compound ID A8CWvK4jqL3
InChI InChI=1S/C9H11NO5/c1-5-8(14-2)6(10(12)13)4-7(11)9(5)15-3/h4,11H,1-3H3
InChIKey JWBFELMAKOXMJL-UHFFFAOYSA-N
Mol Weight 213.19 g/mol
Molecular Formula C9H11NO5
Exact Mass 213.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPhVZCHMXLN
Name 2,4-Dimethoxy-3-methyl-5-nitrophenol
Appearance Orange colored solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.063722453 u
Formula C9H11NO5
InChI InChI=1S/C9H11NO5/c1-5-8(14-2)6(10(12)13)4-7(11)9(5)15-3/h4,11H,1-3H3
InChIKey JWBFELMAKOXMJL-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800359
Molecular Weight 213.189 g/mol
Quality 914
SMILES OC1=C(C(=C(OC)C(=C1)[N+](=O)[O-])C)OC
SPLASH splash10-02e9-9710000000-f7ea387650344502f5c5
Source of Spectrum K1-2018-SM14-5 (DOI: 10.1002/ejoc.201800359)
Thin-Layer Chromatography 0.34 (EtOAc/hexane, 20:80)
Wiley ID 1896929