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4,6-Diacetyl phomosine A oxime
SpectraBase Compound ID 2zoPEa0B4zL
InChI InChI=1S/C22H23NO9/c1-10-7-16(26)15(9-23-28)17(8-10)32-20-11(2)18(22(27)29-6)19(30-13(4)24)12(3)21(20)31-14(5)25/h7-9,26,28H,1-6H3/b23-9+
InChIKey BEXSPCFCSPWNPS-NUGSKGIGSA-N
Mol Weight 445.42 g/mol
Molecular Formula C22H23NO9
Exact Mass 445.137281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzCcJFGGjog
Name 4,6-Diacetyl phomosine A oxime
Appearance white solid
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Formula C22H23NO9
InChI InChI=1S/C22H23NO9/c1-10-7-16(26)15(9-23-28)17(8-10)32-20-11(2)18(22(27)29-6)19(30-13(4)24)12(3)21(20)31-14(5)25/h7-9,26,28H,1-6H3/b23-9+
InChIKey BEXSPCFCSPWNPS-NUGSKGIGSA-N
Instrument Name Thermo Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.607
Molecular Weight 445.424 g/mol
Reported Formula C22H23NO9
SMILES O\N=C\c1c(cc(cc1O)C)Oc1c(c(c(c(c1C)C(OC)=O)OC(C)=O)C)OC(C)=O
SPLASH splash10-0002-0001900000-e1caad2a3706e5ca0001
Source of Spectrum ARK-2012-82-6a
Wiley ID 1864660