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2,4-Dibenzylidene-8-(p-tolyl)-8-azabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID 34jVqsZXza0
InChI InChI=1S/C28H25NO/c1-20-12-14-23(15-13-20)29-26-16-17-27(29)25(19-22-10-6-3-7-11-22)28(30)24(26)18-21-8-4-2-5-9-21/h2-15,18-19,26-27H,16-17H2,1H3/b24-18-,25-19-/t26-,27+
InChIKey UYVNAMVFFKUPHI-DFWIQDSLSA-N
Mol Weight 391.51 g/mol
Molecular Formula C28H25NO
Exact Mass 391.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Qj7A2QoITt
Name 2,4-Dibenzylidene-8-(p-tolyl)-8-azabicyclo[3.2.1]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25NO
InChI InChI=1S/C28H25NO/c1-20-12-14-23(15-13-20)29-26-16-17-27(29)25(19-22-10-6-3-7-11-22)28(30)24(26)18-21-8-4-2-5-9-21/h2-15,18-19,26-27H,16-17H2,1H3/b24-18-,25-19-/t26-,27+
InChIKey UYVNAMVFFKUPHI-DFWIQDSLSA-N
Molecular Weight 391.514 g/mol
SMILES [C@@]12(\C(C(\C([C@@](N2c2ccc(cc2)C)(CC1)[H])=C\c1ccccc1)=O)=C\c1ccccc1)[H]
SPLASH splash10-001i-0109000000-82aa83589cbd453101a4
Source of Spectrum SK-31-3262-2
Synonyms (2Z,4Z)-2,4-dibenzylidene-8-(4-methylphenyl)-8-azabicyclo[3.2.1]octan-3-one
Wiley ID 882232