For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,4-Diketo-5-methoxy-1,2-dimethyl-isoquinoline-1-carbonitrile
SpectraBase Compound ID ESrxvv48m75
InChI InChI=1S/C13H12N2O3/c1-13(7-14)8-5-4-6-9(18-3)10(8)11(16)12(17)15(13)2/h4-6H,1-3H3
InChIKey RRCZKSIMOOEMGG-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C13H12N2O3
Exact Mass 244.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EglVQSunH0X
Name 3,4-Diketo-5-methoxy-1,2-dimethyl-isoquinoline-1-carbonitrile
CAS Registry Number 87486-30-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O3
InChI InChI=1S/C13H12N2O3/c1-13(7-14)8-5-4-6-9(18-3)10(8)11(16)12(17)15(13)2/h4-6H,1-3H3
InChIKey RRCZKSIMOOEMGG-UHFFFAOYSA-N
Molecular Weight 244.250 g/mol
SMILES C1(N(C(c2c(C1=O)c(ccc2)OC)(C#N)C)C)=O
SPLASH splash10-014r-0490000000-9ad3b1a8a02045f489a2
Source of Spectrum Y-20-922-0
Synonyms 5-Methoxy-1,2-dimethyl-3,4-bis(oxidanylidene)isoquinoline-1-carbonitrile 5-Methoxy-1,2-dimethyl-3,4-dioxo-1-isoquinolinecarbonitrile 5-Methoxy-1,2-dimethyl-3,4-dioxo-isoquinoline-1-carbonitrile
Wiley ID 1246875