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2-(ethoxycarbonyl)-1-(1-formyl-2-phenylethyl)-1,2-dihydroisoquinoline
SpectraBase Compound ID 8ZT4RFxzLBT
InChI InChI=1S/C21H21NO3/c1-2-25-21(24)22-13-12-17-10-6-7-11-19(17)20(22)18(15-23)14-16-8-4-3-5-9-16/h3-13,15,18,20H,2,14H2,1H3
InChIKey DUGFEODGHIIGDU-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qfTNnH4CoX
Name 2-(ethoxycarbonyl)-1-(1-formyl-2-phenylethyl)-1,2-dihydroisoquinoline
CAS Registry Number 84955-97-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-2-25-21(24)22-13-12-17-10-6-7-11-19(17)20(22)18(15-23)14-16-8-4-3-5-9-16/h3-13,15,18,20H,2,14H2,1H3
InChIKey DUGFEODGHIIGDU-UHFFFAOYSA-N
Molecular Weight 335.403 g/mol
SMILES C1(N(C=Cc2ccccc12)C(=O)OCC)C(Cc1ccccc1)C=O
SPLASH splash10-0ue9-0790000000-e043d29ab6b4482fa6b0
Source of Spectrum J-50-66-3
Synonyms Ethyl 1-(1-benzyl-2-oxoethyl)-2(1H)-isoquinolinecarboxylate
Wiley ID 1331805