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N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide
SpectraBase Compound ID 57x4cukPDX9
InChI InChI=1S/C27H27N3O3/c1-19(23-10-11-25-26(16-23)33-15-14-32-25)28-29-27(31)22-8-6-20(7-9-22)17-30-13-12-21-4-2-3-5-24(21)18-30/h2-11,16H,12-15,17-18H2,1H3,(H,29,31)/b28-19+
InChIKey SMESUGFHZBOUIN-TURZUDJPSA-N
Mol Weight 441.53 g/mol
Molecular Formula C27H27N3O3
Exact Mass 441.205242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87k82aY95aK
Name N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27N3O3
InChI InChI=1S/C27H27N3O3/c1-19(23-10-11-25-26(16-23)33-15-14-32-25)28-29-27(31)22-8-6-20(7-9-22)17-30-13-12-21-4-2-3-5-24(21)18-30/h2-11,16H,12-15,17-18H2,1H3,(H,29,31)/b28-19+
InChIKey SMESUGFHZBOUIN-TURZUDJPSA-N
Molecular Weight 441.531 g/mol
SMILES N(\N=C\(c1cc2OCCOc2cc1)C)C(c1ccc(CN2Cc3ccccc3CC2)cc1)=O
SPLASH splash10-0ked-6910000000-9b8bea6518bdc502e4eb
Wiley ID 1461849