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1-[3-(5-tert-Butyl-2-furyl)-5-nitrobenzofuran-2-yl]-4,4-dimethylpentan-3-one
SpectraBase Compound ID F6GipBTKAIt
InChI InChI=1S/C23H27NO5/c1-22(2,3)19(25)11-9-17-21(18-10-12-20(29-18)23(4,5)6)15-13-14(24(26)27)7-8-16(15)28-17/h7-8,10,12-13H,9,11H2,1-6H3
InChIKey ZRIJOJXFSOTRQS-UHFFFAOYSA-N
Mol Weight 397.47 g/mol
Molecular Formula C23H27NO5
Exact Mass 397.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxDe8hHMI46
Name 1-[3-(5-tert-Butyl-2-furyl)-5-nitrobenzofuran-2-yl]-4,4-dimethylpentan-3-one
Alternate Name(s) 1-[3-(5-tert-butyl-2-furanyl)-5-nitro-2-benzofuranyl]-4,4-dimethyl-3-pentanone 1-[3-(5-tert-butylfuran-2-yl)-5-nitro-1-benzofuran-2-yl]-4,4-dimethylpentan-3-one 1-[3-(5-tert-butylfuran-2-yl)-5-nitro-1-benzofuran-2-yl]-4,4-dimethyl-pentan-3-one
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Formula C23H27NO5
InChI InChI=1S/C23H27NO5/c1-22(2,3)19(25)11-9-17-21(18-10-12-20(29-18)23(4,5)6)15-13-14(24(26)27)7-8-16(15)28-17/h7-8,10,12-13H,9,11H2,1-6H3
InChIKey ZRIJOJXFSOTRQS-UHFFFAOYSA-N
Molecular Weight 397.471 g/mol
SMILES c1(-c2oc(C(C)(C)C)cc2)c(oc2c1cc(N(=O)=O)cc2)CCC(C(C)(C)C)=O
SPLASH splash10-053s-7049000000-6aeaa7d44b08ce8e39b3
Source of Spectrum Y-48-690-20a
Wiley ID 1667802