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Benzo[f]isoquinoline

View entire compound with spectra: 3 MS (GC)

Benzo[f]isoquinoline
SpectraBase Compound ID KHuAMqeFqFY
InChI InChI=1S/C13H9N/c1-2-4-12-10(3-1)5-6-11-9-14-8-7-13(11)12/h1-9H
InChIKey JQXCGCPMGZBMLE-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C13H9N
Exact Mass 179.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6A15XqzDTcv
Name Benzo[f]isoquinoline
CAS Registry Number 229-67-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9N
InChI InChI=1S/C13H9N/c1-2-4-12-10(3-1)5-6-11-9-14-8-7-13(11)12/h1-9H
InChIKey JQXCGCPMGZBMLE-UHFFFAOYSA-N
Molecular Weight 179.222 g/mol
SMILES c1nccc2c3c(ccc12)cccc3
SPLASH splash10-004i-0900000000-f5986c5498923052e3c6
Source of Spectrum U1-2002-2554-45
Synonyms Benz[f]isoquinoline 5,6-Benzoisoquinoline 2-Azaphenanthrene
Wiley ID 1522925