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(E)-3-(isoquinolin-4-yl)acrylaldehyde
SpectraBase Compound ID 5tSBPztURUo
InChI InChI=1S/C12H9NO/c14-7-3-5-11-9-13-8-10-4-1-2-6-12(10)11/h1-9H/b5-3+
InChIKey ZAGZOIIWVALSBH-HWKANZROSA-N
Mol Weight 183.21 g/mol
Molecular Formula C12H9NO
Exact Mass 183.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82awaQku9mR
Name (E)-3-(isoquinolin-4-yl)acrylaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9NO
InChI InChI=1S/C12H9NO/c14-7-3-5-11-9-13-8-10-4-1-2-6-12(10)11/h1-9H/b5-3+
InChIKey ZAGZOIIWVALSBH-HWKANZROSA-N
Literature Reference DOI 10.1002/adsc.200600593
Molecular Weight 183.210 g/mol
SMILES c1(\C=C\C=O)c2c(cnc1)cccc2
SPLASH splash10-0fai-0900000000-cc546a1d10064ca97c41
Source of Spectrum ASC-349-1128/SM3-3f
Synonyms (E)-3-(4-isoquinolinyl)-2-propenal (E)-3-(4-isoquinolyl)prop-2-enal (E)-3-isoquinolin-4-ylprop-2-enal
Wiley ID 1765621