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Dimethyl (5-Cyano-2-dibenzylamino-6-oxo-6H-1,3-oxazin-4-yl)phosphonate
SpectraBase Compound ID 1MpTj6ySnxd
InChI InChI=1S/C21H20N3O5P/c1-27-30(26,28-2)19-18(13-22)20(25)29-21(23-19)24(14-16-9-5-3-6-10-16)15-17-11-7-4-8-12-17/h3-12H,14-15H2,1-2H3
InChIKey PKTCIRGVTQGLOB-UHFFFAOYSA-N
Mol Weight 425.38 g/mol
Molecular Formula C21H20N3O5P
Exact Mass 425.114058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeJ2t6xZbr3
Name Dimethyl (5-Cyano-2-dibenzylamino-6-oxo-6H-1,3-oxazin-4-yl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N3O5P
InChI InChI=1S/C21H20N3O5P/c1-27-30(26,28-2)19-18(13-22)20(25)29-21(23-19)24(14-16-9-5-3-6-10-16)15-17-11-7-4-8-12-17/h3-12H,14-15H2,1-2H3
InChIKey PKTCIRGVTQGLOB-UHFFFAOYSA-N
Molecular Weight 425.381 g/mol
SMILES C=1(OC(C(=C(N1)P(OC)(OC)=O)C#N)=O)N(Cc1ccccc1)Cc1ccccc1
SPLASH splash10-001l-9505000000-fe0a1be86f17b1c526f3
Source of Spectrum SO-0-445-4
Wiley ID 1543179