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Methyl (1R,2S,3S,5S)-7,7-(2',2'-dimethyltrimethylenedioxy)-3-azidobicyclo[3.3.0]octan-2-oate
SpectraBase Compound ID LktMnIvhJEZ
InChI InChI=1S/C15H23N3O4/c1-14(2)7-21-15(22-8-14)5-9-4-11(17-18-16)12(10(9)6-15)13(19)20-3/h9-12H,4-8H2,1-3H3/t9-,10+,11+,12-/m0/s1
InChIKey FQKSJTCIYOFWJD-QCNOEVLYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C15H23N3O4
Exact Mass 309.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lxii7fMLSyb
Name Methyl (1R,2S,3S,5S)-7,7-(2',2'-dimethyltrimethylenedioxy)-3-azidobicyclo[3.3.0]octan-2-oate
Alternate Name(s) (1R,2S,3R,5S)-7,7-(2',2'-Dimethyltrimethylenedioxy)-3-azidobicyclo[3.3.0]octane-2-carboxylic acid methyl ester Methyl (1R,2S,3R,5S)-7,7-(2',2'-dimethyltrimethylenedioxy)-3-azidobicyclo[3.3.0]octan-2-oate Methyl (3'aR,4'S,5'R,6'aS)-5'-azido-5,5-dimethyl-hexahydro-1'H-spiro[1,3-dioxane-2,2'-pentalene]-4'-carboxylate (1'S,2'R,3'aS,6'aR)-2'-azido-5,5-dimethyl-1'-spiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]carboxylic acid methyl ester Methyl (1'S,2'R,3'aS,6'aR)-2'-azido-5,5-dimethylspiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-1'-carboxylate Methyl (1'S,2'R,3'aS,6'aR)-2'-azido-5,5-dimethyl-spiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-1'-carboxylate
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Formula C15H23N3O4
InChI InChI=1S/C15H23N3O4/c1-14(2)7-21-15(22-8-14)5-9-4-11(17-18-16)12(10(9)6-15)13(19)20-3/h9-12H,4-8H2,1-3H3/t9-,10+,11+,12-/m0/s1
InChIKey FQKSJTCIYOFWJD-QCNOEVLYSA-N
Molecular Weight 309.366 g/mol
SMILES [C@]1([C@]2([C@@](CC3(C2)OCC(CO3)(C)C)([H])C[C@]1(N=[N+]=[N-])[H])[H])(C(=O)OC)[H]
SPLASH splash10-014i-9520000000-25dc130ff67af37553f6
Source of Spectrum F-67-6882-4
Wiley ID 1570982