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7-Hydroxy-1-(p-hydroxyphenetyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium Iodide
SpectraBase Compound ID LdjtbCxPlun
InChI InChI=1S/C20H25NO3.HI/c1-21(2)11-10-15-12-20(24-3)19(23)13-17(15)18(21)9-6-14-4-7-16(22)8-5-14;/h4-5,7-8,12-13,18H,6,9-11H2,1-3H3,(H-,22,23);1H
InChIKey QLMWGGJDWXQNEX-UHFFFAOYSA-N
Mol Weight 455.34 g/mol
Molecular Formula C20H26INO3
Exact Mass 455.095739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtsYRVzIbyN
Name 7-Hydroxy-1-(p-hydroxyphenetyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium Iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26INO3
InChI InChI=1S/C20H25NO3.HI/c1-21(2)11-10-15-12-20(24-3)19(23)13-17(15)18(21)9-6-14-4-7-16(22)8-5-14;/h4-5,7-8,12-13,18H,6,9-11H2,1-3H3,(H-,22,23);1H
InChIKey QLMWGGJDWXQNEX-UHFFFAOYSA-N
Molecular Weight 455.336 g/mol
SMILES [I-].Oc1cc2C(CCc3ccc(cc3)O)[N+](CCc2cc1OC)(C)C
SPLASH splash10-0006-1901000000-6fde0b311af0dbe68060
Source of Spectrum X4-12-113-0
Synonyms 7-Hydroxy-1-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolinium iodide
Wiley ID 1585071