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(19S,20R)(19R,20S)-20-Phenyl-17-azapentacyclo[6.-6-.6.-01,19.02,7.09,14]icosa-2,4,6,9(14),10,12-hexaen-18-one
SpectraBase Compound ID LSGOsRdZQh3
InChI InChI=1S/C25H21NO/c27-24-23-21(16-8-2-1-3-9-16)22-17-10-4-6-12-19(17)25(23,14-15-26-24)20-13-7-5-11-18(20)22/h1-13,21-23H,14-15H2,(H,26,27)/t21-,22-,23-,25+/m1/s1
InChIKey VRJCXJJDHIREHW-WBJOIXBTSA-N
Mol Weight 351.45 g/mol
Molecular Formula C25H21NO
Exact Mass 351.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wkhiIdA2q
Name (19S,20R)(19R,20S)-20-Phenyl-17-azapentacyclo[6.-6-.6.-01,19.02,7.09,14]icosa-2,4,6,9(14),10,12-hexaen-18-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO
InChI InChI=1S/C25H21NO/c27-24-23-21(16-8-2-1-3-9-16)22-17-10-4-6-12-19(17)25(23,14-15-26-24)20-13-7-5-11-18(20)22/h1-13,21-23H,14-15H2,(H,26,27)/t21-,22-,23-,25+/m1/s1
InChIKey VRJCXJJDHIREHW-WBJOIXBTSA-N
Literature Reference DOI 10.1039/c4ob00411f
Molecular Weight 351.449 g/mol
SMILES N1CC[C@@]23c4ccccc4[C@]([C@]([C@@]3(C1=O)[H])(c1ccccc1)[H])(c1c2cccc1)[H]
SPLASH splash10-0udi-0954000000-c0c7f646423afd7eea51
Source of Spectrum F5-12-3221-9
Wiley ID 1747500