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3-(PARA-BENZYLOXYPHENYL)-2,4-DIAZABICYCLO-[4.2.0]-OCTA-1(6),2-DIEN-5-ONE
SpectraBase Compound ID EYmyJpbK7jj
InChI InChI=1S/C19H16N2O2/c22-19-16-10-11-17(16)20-18(21-19)14-6-8-15(9-7-14)23-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,20,21,22)
InChIKey JPKVRMUSIQONCC-UHFFFAOYSA-N
Mol Weight 304.35 g/mol
Molecular Formula C19H16N2O2
Exact Mass 304.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBkjdmBKktb
Name 4-(4-benzoxyphenyl)-3,5-diazabicyclo[4.2.0]octa-1(6),3-dien-2-one
Alternate Name(s) 4-(4-benzyloxyphenyl)-3,5-diazabicyclo[4.2.0]octa-1(6),3-dien-2-one 4-(4-phenylmethoxyphenyl)-3,5-diazabicyclo[4.2.0]octa-1(6),3-dien-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2O2
InChI InChI=1S/C19H16N2O2/c22-19-16-10-11-17(16)20-18(21-19)14-6-8-15(9-7-14)23-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,20,21,22)
InChIKey JPKVRMUSIQONCC-UHFFFAOYSA-N
Molecular Weight 304.349 g/mol
SMILES N1C(C2=C(N=C1c1ccc(cc1)OCc1ccccc1)CC2)=O
SPLASH splash10-0006-9000000000-1a407cda458b2e534f72
Source of Spectrum K1-0-2758-6
Wiley ID 1588981