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3,4-Diketo-7-methoxy-1,2-dimethyl-isoquinoline-1-carbonitrile
SpectraBase Compound ID 4l0uS8zHiOz
InChI InChI=1S/C13H12N2O3/c1-13(7-14)10-6-8(18-3)4-5-9(10)11(16)12(17)15(13)2/h4-6H,1-3H3
InChIKey GIJQKJVVXCTEGX-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C13H12N2O3
Exact Mass 244.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UhUYxvU7wW
Name 3,4-Diketo-7-methoxy-1,2-dimethyl-isoquinoline-1-carbonitrile
Alternate Name(s) 7-Methoxy-1,2-dimethyl-3,4-bis(oxidanylidene)isoquinoline-1-carbonitrile 7-Methoxy-1,2-dimethyl-3,4-dioxo-1-isoquinolinecarbonitrile 7-Methoxy-1,2-dimethyl-3,4-dioxo-isoquinoline-1-carbonitrile
CAS Registry Number 87486-29-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O3
InChI InChI=1S/C13H12N2O3/c1-13(7-14)10-6-8(18-3)4-5-9(10)11(16)12(17)15(13)2/h4-6H,1-3H3
InChIKey GIJQKJVVXCTEGX-UHFFFAOYSA-N
Molecular Weight 244.250 g/mol
SMILES C(#N)C1(C)c2c(C(=O)C(N1C)=O)ccc(c2)OC
SPLASH splash10-0udi-0190000000-c569a500d0c9039f00ec
Source of Spectrum Y-20-921-0
Wiley ID 1246874