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1,4-Ethenoisoquinolin-3(2H)-one, 1,4-dihydro-2-(2-phenylethenyl)-6,7-bis(phenylmethoxy)-, (E)-
SpectraBase Compound ID 3SLoAIMEqke
InChI InChI=1S/C33H27NO3/c35-33-27-16-17-30(34(33)19-18-24-10-4-1-5-11-24)29-21-32(37-23-26-14-8-3-9-15-26)31(20-28(27)29)36-22-25-12-6-2-7-13-25/h1-21,27,30H,22-23H2/b19-18+
InChIKey KKPYZDQVULCZPS-VHEBQXMUSA-N
Mol Weight 485.6 g/mol
Molecular Formula C33H27NO3
Exact Mass 485.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15ym2PC0jeI
Name 1,4-Ethenoisoquinolin-3(2H)-one, 1,4-dihydro-2-(2-phenylethenyl)-6,7-bis(phenylmethoxy)-, (E)-
CAS Registry Number 102249-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H27NO3
InChI InChI=1S/C33H27NO3/c35-33-27-16-17-30(34(33)19-18-24-10-4-1-5-11-24)29-21-32(37-23-26-14-8-3-9-15-26)31(20-28(27)29)36-22-25-12-6-2-7-13-25/h1-21,27,30H,22-23H2/b19-18+
InChIKey KKPYZDQVULCZPS-VHEBQXMUSA-N
Molecular Weight 485.583 g/mol
SMILES C1(N(C2c3c(C1C=C2)cc(c(c3)OCc1ccccc1)OCc1ccccc1)\C=C\c1ccccc1)=O
SPLASH splash10-0006-9374000000-68fb4fe2d5cc35b32f3c
Source of Spectrum Y-22-1059-5
Synonyms 1,4-Etheno-2-(2-trans-phenylvinyl)-6,7-dibenzyloxy-3-oxo-1,2,3,4-tetrahydroisquinoline 4,5-bis(benzyloxy)-9-[(E)-2-phenylethenyl]-9-azatricyclo[6.2.2.0(2,7)]dodeca-2,4,6,11-tetraen-10-one
Wiley ID 1396318