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3-(2',4'-dimethoxyphenyl)-4-nitro-1-phenylbutan-1-one
SpectraBase Compound ID FIidCZomwRB
InChI InChI=1S/C18H19NO5/c1-23-15-8-9-16(18(11-15)24-2)14(12-19(21)22)10-17(20)13-6-4-3-5-7-13/h3-9,11,14H,10,12H2,1-2H3
InChIKey OFOWGTZBYBMUDX-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rly91dTjM1
Name 3-(2',4'-dimethoxyphenyl)-4-nitro-1-phenylbutan-1-one
Alternate Name(s) 3-(2,4-dimethoxyphenyl)-4-nitro-1-phenylbutan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO5
InChI InChI=1S/C18H19NO5/c1-23-15-8-9-16(18(11-15)24-2)14(12-19(21)22)10-17(20)13-6-4-3-5-7-13/h3-9,11,14H,10,12H2,1-2H3
InChIKey OFOWGTZBYBMUDX-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES C(CC(C[N+](=O)[O-])c1c(cc(cc1)OC)OC)(=O)c1ccccc1
SPLASH splash10-0a4i-2910000000-90a579b6af6e93ab75b1
Source of Spectrum ASC-350-1218/SM7-3d
Wiley ID 1766387