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3-PHENYL-3-AZA-9,10;11,12-DIBENZOTRICYCLO-[6.2.2.0(1,6)]-DODECA-5,9,11-TRIEN-4-ONE
SpectraBase Compound ID 1xMcKLyeFoY
InChI InChI=1S/C25H19NO/c27-24-15-17-14-21-19-10-4-6-12-22(19)25(17,23-13-7-5-11-20(21)23)16-26(24)18-8-2-1-3-9-18/h1-13,15,21H,14,16H2/t21-,25+
InChIKey GIGVSDXUXYVHHA-IVHGUIJPSA-N
Mol Weight 349.43 g/mol
Molecular Formula C25H19NO
Exact Mass 349.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fv8QD3uwxUl
Name 3H-6,10b[1',2']-Benzenobenz[h]isoquinolin-3-one, 1,2,5,6-tetrahydro-2-phenyl-
CAS Registry Number 117776-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19NO
InChI InChI=1S/C25H19NO/c27-24-15-17-14-21-19-10-4-6-12-22(19)25(17,23-13-7-5-11-20(21)23)16-26(24)18-8-2-1-3-9-18/h1-13,15,21H,14,16H2/t21-,25+
InChIKey GIGVSDXUXYVHHA-IVHGUIJPSA-N
Molecular Weight 349.433 g/mol
SMILES c1ccc2c([C@]3(CC=4[C@@]2(c2c3cccc2)CN(C(C4)=O)c2ccccc2)[H])c1
SPLASH splash10-0002-0069000000-23337dc8a799893aec86
Source of Spectrum K-122-583-8
Wiley ID 1341541