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(2-methyl-2-nitro-1-oxidanylidene-1-phenyl-octan-4-yl) ethanoate
SpectraBase Compound ID L00JVII9ZMI
InChI InChI=1S/C17H23NO5/c1-4-5-11-15(23-13(2)19)12-17(3,18(21)22)16(20)14-9-7-6-8-10-14/h6-10,15H,4-5,11-12H2,1-3H3
InChIKey AFFMWWSEWYZQCF-UHFFFAOYSA-N
Mol Weight 321.37 g/mol
Molecular Formula C17H23NO5
Exact Mass 321.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZM5d95htID
Name (2-methyl-2-nitro-1-oxidanylidene-1-phenyl-octan-4-yl) ethanoate
Alternate Name(s) (2-methyl-2-nitro-1-oxo-1-phenyloctan-4-yl) acetate 1-(2-Methyl-2-nitro-3-oxo-3-phenyl-propyl)pentyl acetate Acetic acid (2-methyl-2-nitro-1-oxo-1-phenyloctan-4-yl) ester Acetic acid 1-(3-keto-2-methyl-2-nitro-3-phenyl-propyl)pentyl ester
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Formula C17H23NO5
InChI InChI=1S/C17H23NO5/c1-4-5-11-15(23-13(2)19)12-17(3,18(21)22)16(20)14-9-7-6-8-10-14/h6-10,15H,4-5,11-12H2,1-3H3
InChIKey AFFMWWSEWYZQCF-UHFFFAOYSA-N
Molecular Weight 321.373 g/mol
SMILES C(N(=O)=O)(C(=O)c1ccccc1)(CC(OC(=O)C)CCCC)C
SPLASH splash10-0a4i-1900000000-a361ef7aa0ff75e797c8
Source of Spectrum KC-0-2035-12
Wiley ID 781638