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6-(1,3-Benzodioxol-5-yl)-2-oxo-4-phenyl-1,2-dihydro-3-pyridinecarbonitrile
SpectraBase Compound ID 3vTS48ny8ah
InChI InChI=1S/C19H12N2O3/c20-10-15-14(12-4-2-1-3-5-12)9-16(21-19(15)22)13-6-7-17-18(8-13)24-11-23-17/h1-9H,11H2,(H,21,22)
InChIKey IJQLMDBVAOBTBR-UHFFFAOYSA-N
Mol Weight 316.32 g/mol
Molecular Formula C19H12N2O3
Exact Mass 316.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRE8O7R8RLq
Name 6-(1,3-Benzodioxol-5-yl)-2-oxo-4-phenyl-1,2-dihydro-3-pyridinecarbonitrile
Alternate Name(s) 6-(1,3-benzodioxol-5-yl)-2-keto-4-phenyl-1H-pyridine-3-carbonitrile 6-(1,3-benzodioxol-5-yl)-2-oxidanylidene-4-phenyl-1H-pyridine-3-carbonitrile 6-(1,3-benzodioxol-5-yl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile Pyridine-3-carbonitrile, 1,2-dihydro-6-(1,3-benzodioxol-5-yl)-2-oxo-4-phenyl-
CAS Registry Number 351066-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12N2O3
InChI InChI=1S/C19H12N2O3/c20-10-15-14(12-4-2-1-3-5-12)9-16(21-19(15)22)13-6-7-17-18(8-13)24-11-23-17/h1-9H,11H2,(H,21,22)
InChIKey IJQLMDBVAOBTBR-UHFFFAOYSA-N
Molecular Weight 316.316 g/mol
SMILES N1C(C(=C(C=C1c1cc2OCOc2cc1)c1ccccc1)C#N)=O
SPLASH splash10-014i-2109000000-1568a84e8d20532514e8
Source of Spectrum AD-0-2532-0
Wiley ID 1429229