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Di-tert-Butyl (Z)-4-oxocycloundeca-10-ene-cis-1,2-dicarboxylate
SpectraBase Compound ID GNQHyBZfVK7
InChI InChI=1S/C21H34O5/c1-20(2,3)25-18(23)16-13-11-9-7-8-10-12-15(22)14-17(16)19(24)26-21(4,5)6/h11,13,16-17H,7-10,12,14H2,1-6H3/b13-11-/t16-,17+/m1/s1
InChIKey HWMGKVAPEYLMIN-IDPHKLQDSA-N
Mol Weight 366.5 g/mol
Molecular Formula C21H34O5
Exact Mass 366.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LtAEzMWU7q
Name Di-tert-Butyl (Z)-4-oxocycloundeca-10-ene-cis-1,2-dicarboxylate
Alternate Name(s) (Z)-(1S,2R)-10-Oxo-cycloundec-3-ene-1,2-dicarboxylic acid di-tert-butyl ester di(tert-butyl) (1S,2R)-10-oxo-3-cycloundecene-1,2-dicarboxylate
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Formula C21H34O5
InChI InChI=1S/C21H34O5/c1-20(2,3)25-18(23)16-13-11-9-7-8-10-12-15(22)14-17(16)19(24)26-21(4,5)6/h11,13,16-17H,7-10,12,14H2,1-6H3/b13-11-/t16-,17+/m1/s1
InChIKey HWMGKVAPEYLMIN-IDPHKLQDSA-N
Molecular Weight 366.498 g/mol
SMILES C([C@@]1([C@](C(OC(C)(C)C)=O)(\C=C/CCCCCC(C1)=O)[H])[H])(OC(C)(C)C)=O
SPLASH splash10-0a4i-9260000000-278ac6bcb78812759427
Source of Spectrum SO-0-1338-19
Wiley ID 878014