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3-[4-(Naphth-2-yl)phenyl]-2-azatricyclo[7.4.0.1(4,8)]tetradeca-4,9(1),10,12-tetraene-14-one
SpectraBase Compound ID DxWHKIXO5EE
InChI InChI=1S/C29H23NO/c31-29-25-9-5-10-26(29)28(30-27-11-4-3-8-24(25)27)21-15-12-20(13-16-21)23-17-14-19-6-1-2-7-22(19)18-23/h1-4,6-8,10-18,25,28,30H,5,9H2/t25-,28?/m1/s1
InChIKey URPXJSLRFLGSRN-RXVAYIKUSA-N
Mol Weight 401.51 g/mol
Molecular Formula C29H23NO
Exact Mass 401.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 662PSIlxUPc
Name 3-[4-(Naphth-2-yl)phenyl]-2-azatricyclo[7.4.0.1(4,8)]tetradeca-4,9(1),10,12-tetraene-14-one
Alternate Name(s) 9-[4-(2-naphthyl)phenyl]-8-azatricyclo[8.3.1.0(2,7)]tetradeca-2,4,6,10-tetraen-14-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H23NO
InChI InChI=1S/C29H23NO/c31-29-25-9-5-10-26(29)28(30-27-11-4-3-8-24(25)27)21-15-12-20(13-16-21)23-17-14-19-6-1-2-7-22(19)18-23/h1-4,6-8,10-18,25,28,30H,5,9H2/t25-,28?/m1/s1
InChIKey URPXJSLRFLGSRN-RXVAYIKUSA-N
Molecular Weight 401.509 g/mol
SMILES N1c2ccccc2[C@@]2(C(C(C1c1ccc(-c3cc4ccccc4cc3)cc1)=CCC2)=O)[H]
SPLASH splash10-056r-0009000000-369d15d62b3ef7c3b374
Source of Spectrum H1-51-553-4
Wiley ID 817082