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Isoquinoline, 8-isocyano-6,7-dimethoxy-1-methyl-
SpectraBase Compound ID D2dpDiGiS0g
InChI InChI=1S/C13H12N2O2/c1-8-11-9(5-6-15-8)7-10(16-3)13(17-4)12(11)14-2/h5-7H,1,3-4H3
InChIKey MMLBLTDWTORKQK-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bq2TzfGE1d0
Name Isoquinoline, 8-isocyano-6,7-dimethoxy-1-methyl-
CAS Registry Number 128428-49-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-8-11-9(5-6-15-8)7-10(16-3)13(17-4)12(11)14-2/h5-7H,1,3-4H3
InChIKey MMLBLTDWTORKQK-UHFFFAOYSA-N
Molecular Weight 228.251 g/mol
SMILES c1(c2c(ccnc2C)cc(c1OC)OC)[N+]#[C-]
SPLASH splash10-004i-0790000000-cd3a191f21afddf3ffa3
Source of Spectrum KC-1990-3196-3
Synonyms 1-Methyl-6,7-dimethoxy-8-isoquinolyl isocyanide 8-isocyano-6,7-dimethoxy-1-methylisoquinoline
Wiley ID 1229686