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2,4-Dimethoxy-3-methyl-5-nitrophenyl acetate
SpectraBase Compound ID LwA9obq1x9S
InChI InChI=1S/C11H13NO6/c1-6-10(16-3)8(12(14)15)5-9(11(6)17-4)18-7(2)13/h5H,1-4H3
InChIKey GULLLZJSMGNPPM-UHFFFAOYSA-N
Mol Weight 255.23 g/mol
Molecular Formula C11H13NO6
Exact Mass 255.074287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OIutXE12BH
Name 2,4-Dimethoxy-3-methyl-5-nitrophenyl Acetate
Appearance Yellow liquid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.074287137 u
Formula C11H13NO6
InChI InChI=1S/C11H13NO6/c1-6-10(16-3)8(12(14)15)5-9(11(6)17-4)18-7(2)13/h5H,1-4H3
InChIKey GULLLZJSMGNPPM-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800359
Molecular Weight 255.226 g/mol
Quality 914
SMILES COC1=C(C(=C(C=C1[N+](=O)[O-])OC(C)=O)OC)C
SPLASH splash10-03di-9850000000-b3aa8c35d6785dc65197
Source of Spectrum K1-2018-SM11-4 (DOI: 10.1002/ejoc.201800359)
Thin-Layer Chromatography 0.70 (EtOAc/hexane, 40:60)
Wiley ID 1896928