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5-(N-Allylamino)-3,6-dimethylindole-4,7-dione
SpectraBase Compound ID 1kxSHP4kIO1
InChI InChI=1S/C13H14N2O2/c1-4-5-14-10-8(3)12(16)11-9(13(10)17)7(2)6-15-11/h4,6,14-15H,1,5H2,2-3H3
InChIKey BBOKQEPFGUPFDS-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dwsbt9KLgy
Name 5-(N-Allylamino)-3,6-dimethylindole-4,7-dione
Alternate Name(s) 5-(allylamino)-3,6-dimethyl-1H-indole-4,7-dione
CAS Registry Number 98217-13-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-4-5-14-10-8(3)12(16)11-9(13(10)17)7(2)6-15-11/h4,6,14-15H,1,5H2,2-3H3
InChIKey BBOKQEPFGUPFDS-UHFFFAOYSA-N
Molecular Weight 230.267 g/mol
SMILES N(C=1C(c2c(C(C1C)=O)[nH]cc2C)=O)CC=C
SPLASH splash10-00lr-0090000000-a40f49ae2cda2238002d
Source of Spectrum J-50-4286-14
Wiley ID 1231811