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5-Methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propylindole-4,7-dione
SpectraBase Compound ID J94mJ2e2lDl
InChI InChI=1S/C21H22N2O6/c1-5-10-22-13(3)16(11-29-15-8-6-14(7-9-15)23(26)27)17-18(22)19(24)12(2)21(28-4)20(17)25/h6-9H,5,10-11H2,1-4H3
InChIKey GTPAGSNZQSTTEE-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C21H22N2O6
Exact Mass 398.147786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7diW8Ssdji
Name 5-Methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propylindole-4,7-dione
Alternate Name(s) 5-Methoxy-2,6-dimethyl-3-[(4-nitrophenoxy)methyl]-1-propyl-indole-4,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O6
InChI InChI=1S/C21H22N2O6/c1-5-10-22-13(3)16(11-29-15-8-6-14(7-9-15)23(26)27)17-18(22)19(24)12(2)21(28-4)20(17)25/h6-9H,5,10-11H2,1-4H3
InChIKey GTPAGSNZQSTTEE-UHFFFAOYSA-N
Molecular Weight 398.415 g/mol
SMILES c1([n](c2C(C(=C(C(c2c1COc1ccc(cc1)N(=O)=O)=O)OC)C)=O)CCC)C
SPLASH splash10-03di-0090000000-298ff9d6110d24505577
Source of Spectrum K-2001-858-46
Wiley ID 1580384