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(4R,6S) and (4S,6R)-4-(3,5-dinitrobenzoyloxy)-1,7-dioxasipro[5.5]undecane
SpectraBase Compound ID LB9ZhvQXW6x
InChI InChI=1S/C16H18N2O8/c19-15(11-7-12(17(20)21)9-13(8-11)18(22)23)26-14-3-6-25-16(10-14)4-1-2-5-24-16/h7-9,14H,1-6,10H2/t14-,16+/m0/s1
InChIKey YKNWCWQMPAHSQJ-GOEBONIOSA-N
Mol Weight 366.33 g/mol
Molecular Formula C16H18N2O8
Exact Mass 366.106316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DGLcAiyLZB
Name (4R,6S) and (4S,6R)-4-(3,5-dinitrobenzoyloxy)-1,7-dioxasipro[5.5]undecane
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Formula C16H18N2O8
InChI InChI=1S/C16H18N2O8/c19-15(11-7-12(17(20)21)9-13(8-11)18(22)23)26-14-3-6-25-16(10-14)4-1-2-5-24-16/h7-9,14H,1-6,10H2/t14-,16+/m0/s1
InChIKey YKNWCWQMPAHSQJ-GOEBONIOSA-N
Molecular Weight 366.326 g/mol
SMILES c1(N(=O)=O)cc(N(=O)=O)cc(C(O[C@@]2(C[C@]3(OCCCC3)OCC2)[H])=O)c1
SPLASH splash10-052b-9300000000-d1d0592b6ed29d47418f
Source of Spectrum KC-1987-1126-21
Synonyms (4S,6R)-1,7-dioxaspiro[5.5]undec-4-yl 3,5-dinitrobenzoate
Wiley ID 1351705