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Methyl 1-(4-(benzyloxy)phenyl)-4-phenylisoquinoline-3-carboxylate
SpectraBase Compound ID Bi6PeB7e2V6
InChI InChI=1S/C30H23NO3/c1-33-30(32)29-27(22-12-6-3-7-13-22)25-14-8-9-15-26(25)28(31-29)23-16-18-24(19-17-23)34-20-21-10-4-2-5-11-21/h2-19H,20H2,1H3
InChIKey JCZGSVQDZNQUKX-UHFFFAOYSA-N
Mol Weight 445.52 g/mol
Molecular Formula C30H23NO3
Exact Mass 445.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTBfwYwFleO
Name Methyl 1-(4-(benzyloxy)phenyl)-4-phenylisoquinoline-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H23NO3
InChI InChI=1S/C30H23NO3/c1-33-30(32)29-27(22-12-6-3-7-13-22)25-14-8-9-15-26(25)28(31-29)23-16-18-24(19-17-23)34-20-21-10-4-2-5-11-21/h2-19H,20H2,1H3
InChIKey JCZGSVQDZNQUKX-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc06427e
Molecular Weight 445.518 g/mol
SMILES c1cc2c(-c3ccccc3)c(nc(-c3ccc(cc3)OCc3ccccc3)c2cc1)C(OC)=O
SPLASH splash10-0006-9020400000-25b227bfb2afb568f7c7
Source of Spectrum KD-50-13485/SMS12-3j
Wiley ID 1754919