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Isoquinoline, 2-[(5-acetyl-3-pyridinyl)carbonyl]-1,2,3,4-tetrahydro-7-methoxy-1-methylene-6-(phenylmethoxy)-
SpectraBase Compound ID 8e8B7RZuoY9
InChI InChI=1S/C26H24N2O4/c1-17-23-13-24(31-3)25(32-16-19-7-5-4-6-8-19)12-20(23)9-10-28(17)26(30)22-11-21(18(2)29)14-27-15-22/h4-8,11-15H,1,9-10,16H2,2-3H3
InChIKey NEYMWALWJICNOS-UHFFFAOYSA-N
Mol Weight 428.49 g/mol
Molecular Formula C26H24N2O4
Exact Mass 428.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IybJ2WTSiSy
Name Isoquinoline, 2-[(5-acetyl-3-pyridinyl)carbonyl]-1,2,3,4-tetrahydro-7-methoxy-1-methylene-6-(phenylmethoxy)-
CAS Registry Number 132148-47-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24N2O4
InChI InChI=1S/C26H24N2O4/c1-17-23-13-24(31-3)25(32-16-19-7-5-4-6-8-19)12-20(23)9-10-28(17)26(30)22-11-21(18(2)29)14-27-15-22/h4-8,11-15H,1,9-10,16H2,2-3H3
InChIKey NEYMWALWJICNOS-UHFFFAOYSA-N
Molecular Weight 428.488 g/mol
SMILES C1(N(CCc2cc(c(cc12)OC)OCc1ccccc1)C(c1cc(C(=O)C)cnc1)=O)=C
SPLASH splash10-0006-9110000000-f9fee94d104617a7dd6c
Source of Spectrum F-46-7898-9
Synonyms 1-{5-[(6-(benzyloxy)-7-methoxy-1-methylene-3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]-3-pyridinyl}ethanone 6-Benzyloxy-7-methoxy-1-methylene-N(2)-[(3'-acetyl-pyridin-5'-yl)-carbonyl]-1,2,3,4-tetrahydro-isoquinoline
Wiley ID 1380779