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6-Amino-4-benzylidene-2-(4-nitrophenyl)-3,4-dihydro-2H-pyran-5-carbonitrile
SpectraBase Compound ID 4ZTU8QTnVms
InChI InChI=1S/C19H15N3O3/c20-12-17-15(10-13-4-2-1-3-5-13)11-18(25-19(17)21)14-6-8-16(9-7-14)22(23)24/h1-10,18H,11,21H2
InChIKey GVALHRPQNBVIAB-UHFFFAOYSA-N
Mol Weight 333.35 g/mol
Molecular Formula C19H15N3O3
Exact Mass 333.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HsnBu7VwL2Q
Name 6-Amino-4-benzylidene-2-(4-nitrophenyl)-3,4-dihydro-2H-pyran-5-carbonitrile
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3O3
InChI InChI=1S/C19H15N3O3/c20-12-17-15(10-13-4-2-1-3-5-13)11-18(25-19(17)21)14-6-8-16(9-7-14)22(23)24/h1-10,18H,11,21H2
InChIKey GVALHRPQNBVIAB-UHFFFAOYSA-N
Instrument Name Finnigan-MAT-8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3570
Molecular Weight 333.347 g/mol
SMILES NC1=C(C(CC(O1)c1ccc(cc1)[N+](=O)[O-])=Cc1ccccc1)C#N
SPLASH splash10-00fr-6910000000-948f61680299e0d02e86
Source of Spectrum Y-56-1855-4m
Thin-Layer Chromatography Rf = 0.58 (hexane/EtOAc, 1:1)
Wiley ID 1859586