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Benzo[f]pyrrolo[2,1-a]isoquinoline-6-carbonitrile, 1,2,4,5-tetrahydro-2,2-dimethyl-4,5-dioxo-
SpectraBase Compound ID Aw6CX27OfEe
InChI InChI=1S/C19H14N2O2/c1-19(2)9-14-12-6-4-3-5-11(12)7-8-13(14)16-15(10-20)17(22)18(23)21(16)19/h3-8H,9H2,1-2H3
InChIKey NIZAQWXZMNJHFQ-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C19H14N2O2
Exact Mass 302.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nyaJcMHHPL
Name Benzo[F]pyrrolo[2,1-A]isoquinoline-6-carbonitrile, 1,2,4,5-tetrahydro-2,2-dimethyl-4,5-dioxo-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.105527697 u
Formula C19H14N2O2
InChI InChI=1S/C19H14N2O2/c1-19(2)9-14-12-6-4-3-5-11(12)7-8-13(14)16-15(10-20)17(22)18(23)21(16)19/h3-8H,9H2,1-2H3
InChIKey NIZAQWXZMNJHFQ-UHFFFAOYSA-N
SMILES C1=CC=C2C(=C1)C=CC=1C=3N(C(=O)C(C3C#N)=O)C(C)(C)CC21