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4-Chloropyrimido[5,4-c]isoquinoline
SpectraBase Compound ID VR4kUc5ESM
InChI InChI=1S/C11H6ClN3/c12-11-10-9(14-6-15-11)8-4-2-1-3-7(8)5-13-10/h1-6H
InChIKey OSMZYPQKDRIBSX-UHFFFAOYSA-N
Mol Weight 215.64 g/mol
Molecular Formula C11H6ClN3
Exact Mass 215.025025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jW6LbjPx59
Name 4-Chloropyrimido[5,4-c]isoquinoline
Appearance Crystalline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 215.025024905 u
Formula C11H6ClN3
InChI InChI=1S/C11H6ClN3/c12-11-10-9(14-6-15-11)8-4-2-1-3-7(8)5-13-10/h1-6H
InChIKey OSMZYPQKDRIBSX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo3027033
Molecular Weight 215.643 g/mol
Quality 41
Reported Formula C11H6N3Cl
SMILES C12=NC=NC(=C2N=CC2=C1C=CC=C2)Cl
SPLASH splash10-014i-0590000000-d8b34b7830392504e47d
Source of Spectrum JOC-78-1315-3k (DOI: 10.1021/jo3027033)
Wiley ID 1912225