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6-Allyl-3-formyl-1-(phenylamino)-5,8-isoquinone
SpectraBase Compound ID KMYgHp6cDjo
InChI InChI=1S/C19H14N2O3/c1-2-6-12-9-16(23)17-15(18(12)24)10-14(11-22)21-19(17)20-13-7-4-3-5-8-13/h2-5,7-11H,1,6H2,(H,20,21)
InChIKey KNFPQZMTCBNMRR-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C19H14N2O3
Exact Mass 318.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZM6cyHGbqI
Name 6-Allyl-3-formyl-1-(phenylamino)-5,8-isoquinone
CAS Registry Number 129708-05-0
Comments Less than 3 mono-isotopic peaks
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Formula C19H14N2O3
InChI InChI=1S/C19H14N2O3/c1-2-6-12-9-16(23)17-15(18(12)24)10-14(11-22)21-19(17)20-13-7-4-3-5-8-13/h2-5,7-11H,1,6H2,(H,20,21)
InChIKey KNFPQZMTCBNMRR-UHFFFAOYSA-N
Molecular Weight 318.332 g/mol
SMILES N(c1c2c(C(=O)C(=CC2=O)CC=C)cc(C=O)n1)c1ccccc1
SPLASH splash10-001i-9001000000-69537dfe29643eeb6f3e
Source of Spectrum J-55-6145-10
Synonyms 6-allyl-1-anilino-5,8-dioxo-5,8-dihydro-3-isoquinolinecarbaldehyde
Wiley ID 1318590