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2-(tert-butylamino)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3,4-dicarboxylic acid ditert-butyl ester
SpectraBase Compound ID CxwY8vdRGlA
InChI InChI=1S/C25H39NO6/c1-22(2,3)26-19-18(21(29)32-24(7,8)9)17(20(28)31-23(4,5)6)16-14(27)12-25(10,11)13-15(16)30-19/h17,26H,12-13H2,1-11H3
InChIKey AEOGBUXPXLKKFX-UHFFFAOYSA-N
Mol Weight 449.6 g/mol
Molecular Formula C25H39NO6
Exact Mass 449.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNKpBfYeTcj
Name 2-(tert-butylamino)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3,4-dicarboxylic acid ditert-butyl ester
Alternate Name(s) 2-(tert-butylamino)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3,4-dicarboxylic acid ditert-butyl ester ditert-butyl 2-(tert-butylamino)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3,4-dicarboxylate ditert-butyl 2-(tert-butylamino)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3,4-dicarboxylate
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Formula C25H39NO6
InChI InChI=1S/C25H39NO6/c1-22(2,3)26-19-18(21(29)32-24(7,8)9)17(20(28)31-23(4,5)6)16-14(27)12-25(10,11)13-15(16)30-19/h17,26H,12-13H2,1-11H3
InChIKey AEOGBUXPXLKKFX-UHFFFAOYSA-N
Molecular Weight 449.588 g/mol
SMILES N(C1=C(C(C=2C(CC(CC2O1)(C)C)=O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)C
SPLASH splash10-00kf-0091100000-857df1cca4d0b57be08f
Source of Spectrum AH-134-1590-4
Wiley ID 1547029