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4,6-Diacetyl-3'-ethyl phomosine A oxime ethylether
SpectraBase Compound ID 2CgHvvatREl
InChI InChI=1S/C26H31NO9/c1-9-32-20-11-14(3)12-21(19(20)13-27-33-10-2)36-24-15(4)22(26(30)31-8)23(34-17(6)28)16(5)25(24)35-18(7)29/h11-13H,9-10H2,1-8H3/b27-13+
InChIKey LRBFKFMBBBDZEN-UVHMKAGCSA-N
Mol Weight 501.53 g/mol
Molecular Formula C26H31NO9
Exact Mass 501.199882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9soowlS88zN
Name 4,6-Diacetyl-3'-ethyl phomosine A oxime ethylether
Appearance White crystals
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Formula C26H31NO9
InChI InChI=1S/C26H31NO9/c1-9-32-20-11-14(3)12-21(19(20)13-27-33-10-2)36-24-15(4)22(26(30)31-8)23(34-17(6)28)16(5)25(24)35-18(7)29/h11-13H,9-10H2,1-8H3/b27-13+
InChIKey LRBFKFMBBBDZEN-UVHMKAGCSA-N
Instrument Name Thermo Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.607
Molecular Weight 501.532 g/mol
Reported Formula C26H31NO9
SMILES c1(c(c(c(c(c1OC(C)=O)C(OC)=O)C)Oc1cc(cc(c1\C=N\OCC)OCC)C)OC(C)=O)C
SPLASH splash10-0h90-0129440000-a17a7ab5f3052d18dda7
Source of Spectrum ARK-2012-83-6c
Wiley ID 1864661