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2,4-Dibenzylidene-8-(p-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID Bc79iiTnQ6z
InChI InChI=1S/C28H25NO2/c1-31-23-14-12-22(13-15-23)29-26-16-17-27(29)25(19-21-10-6-3-7-11-21)28(30)24(26)18-20-8-4-2-5-9-20/h2-15,18-19,26-27H,16-17H2,1H3/b24-18-,25-19-/t26-,27+
InChIKey MQQVEJUOLAMCFF-DFWIQDSLSA-N
Mol Weight 407.51 g/mol
Molecular Formula C28H25NO2
Exact Mass 407.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eee2RSAYHZ5
Name 2,4-Dibenzylidene-8-(p-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-one
Alternate Name(s) (2Z,4Z)-2,4-dibenzylidene-8-(4-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25NO2
InChI InChI=1S/C28H25NO2/c1-31-23-14-12-22(13-15-23)29-26-16-17-27(29)25(19-21-10-6-3-7-11-21)28(30)24(26)18-20-8-4-2-5-9-20/h2-15,18-19,26-27H,16-17H2,1H3/b24-18-,25-19-/t26-,27+
InChIKey MQQVEJUOLAMCFF-DFWIQDSLSA-N
Molecular Weight 407.513 g/mol
SMILES [C@@]12(\C(C(\C([C@@](N2c2ccc(cc2)OC)(CC1)[H])=C\c1ccccc1)=O)=C\c1ccccc1)[H]
SPLASH splash10-056r-0009500000-68506ba7bdf639ef593f
Source of Spectrum SK-31-3262-2
Wiley ID 882231