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1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-5'-yl]ethanone and 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-6'-yl]ethanone

View entire compound with spectra: 1 MS (GC)

1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-5'-yl]ethanone and 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-6'-yl]ethanone
SpectraBase Compound ID KOLtJD4XxGm
InChI InChI=1S/C15H18N2O3/c1-10(18)11-5-6-14-13(7-11)12(9-16(14)4)8-15(2,3)17(19)20/h5-7,9H,8H2,1-4H3
InChIKey IQXBALXJWFZYCY-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C15H18N2O3
Exact Mass 274.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXGI7sASNLy
Name 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-5'-yl]ethanone and 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-6'-yl]ethanone
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Formula C15H18N2O3
InChI InChI=1S/C15H18N2O3/c1-10(18)11-5-6-14-13(7-11)12(9-16(14)4)8-15(2,3)17(19)20/h5-7,9H,8H2,1-4H3
InChIKey IQXBALXJWFZYCY-UHFFFAOYSA-N
Molecular Weight 274.320 g/mol
SMILES c1(c2c(ccc(c2)C(=O)C)[n](c1)C)CC(N(=O)=O)(C)C
SPLASH splash10-000i-0940000000-00e108ae88257b1ee557
Source of Spectrum B-46-1725-0
Synonyms 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-5'-yl]ethanone and 1-[1'-methyl-3'-(2''-methyl-2''-nitropropyl)indol-6'-yl]ethanone 1-[1-methyl-3-(2-methyl-2-nitropropyl)-1H-indol-5-yl]ethanone
Wiley ID 1278106