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2-(tert-butylamino)-8-formyl-6-methoxy-4H-1-benzopyran-3,4-dicarboxylic acid ditert-butyl ester
SpectraBase Compound ID 2vUKizuQD43
InChI InChI=1S/C25H35NO7/c1-23(2,3)26-20-18(22(29)33-25(7,8)9)17(21(28)32-24(4,5)6)16-12-15(30-10)11-14(13-27)19(16)31-20/h11-13,17,26H,1-10H3
InChIKey HKDNQGVSVJWBQN-UHFFFAOYSA-N
Mol Weight 461.6 g/mol
Molecular Formula C25H35NO7
Exact Mass 461.241352 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnR4ZqIUh46
Name 2-(tert-butylamino)-8-formyl-6-methoxy-4H-1-benzopyran-3,4-dicarboxylic acid ditert-butyl ester
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Formula C25H35NO7
InChI InChI=1S/C25H35NO7/c1-23(2,3)26-20-18(22(29)33-25(7,8)9)17(21(28)32-24(4,5)6)16-12-15(30-10)11-14(13-27)19(16)31-20/h11-13,17,26H,1-10H3
InChIKey HKDNQGVSVJWBQN-UHFFFAOYSA-N
Molecular Weight 461.555 g/mol
SMILES N(C1=C(C(c2cc(cc(c2O1)C=O)OC)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(C)(C)C
SPLASH splash10-0bta-9056800000-e1470454093bfa3bfb55
Source of Spectrum C5-2004-682-12
Synonyms 2-(tert-butylamino)-8-formyl-6-methoxy-4H-chromene-3,4-dicarboxylic acid ditert-butyl ester ditert-butyl 2-(tert-butylamino)-8-methanoyl-6-methoxy-4H-chromene-3,4-dicarboxylate
Wiley ID 1616777