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2-(4-hydroxy-3-nitrophenyl)-1-(4-methoxyphenyl)butan-1-one
SpectraBase Compound ID LghCfZzoBcf
InChI InChI=1S/C17H17NO5/c1-3-14(12-6-9-16(19)15(10-12)18(21)22)17(20)11-4-7-13(23-2)8-5-11/h4-10,14,19H,3H2,1-2H3
InChIKey RPEMLTARFYAEAM-UHFFFAOYSA-N
Mol Weight 315.32 g/mol
Molecular Formula C17H17NO5
Exact Mass 315.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tSb1scc9PX
Name 2-(4-hydroxy-3-nitrophenyl)-1-(4-methoxyphenyl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO5
InChI InChI=1S/C17H17NO5/c1-3-14(12-6-9-16(19)15(10-12)18(21)22)17(20)11-4-7-13(23-2)8-5-11/h4-10,14,19H,3H2,1-2H3
InChIKey RPEMLTARFYAEAM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19813140312
Molecular Weight 315.325 g/mol
SMILES [N+](=O)([O-])c1cc(ccc1O)C(C(c1ccc(cc1)OC)=O)CC
SPLASH splash10-01p9-3900000000-8c3bf5acf3c1fc258a9f
Source of Spectrum APC-314-263-12
Wiley ID 1787926