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4H-Quinolizin-4-one, octahydro-6-(3-iodo-4-methoxyphenyl)-8-(phenylmethoxy)-, (6.alpha.,8.beta.,9a.alpha.)-(.+-.)-
SpectraBase Compound ID Gme57zapTr0
InChI InChI=1S/C23H26INO3/c1-27-22-11-10-17(12-20(22)24)21-14-19(28-15-16-6-3-2-4-7-16)13-18-8-5-9-23(26)25(18)21/h2-4,6-7,10-12,18-19,21H,5,8-9,13-15H2,1H3/t18-,19+,21+/m1/s1
InChIKey SHSRLZLVIDRDNF-DYXWJJEUSA-N
Mol Weight 491.37 g/mol
Molecular Formula C23H26INO3
Exact Mass 491.095739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KysDRrHh1L0
Name 4H-Quinolizin-4-one, octahydro-6-(3-iodo-4-methoxyphenyl)-8-(phenylmethoxy)-, (6.alpha.,8.beta.,9a.alpha.)-(.+-.)-
CAS Registry Number 97974-73-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26INO3
InChI InChI=1S/C23H26INO3/c1-27-22-11-10-17(12-20(22)24)21-14-19(28-15-16-6-3-2-4-7-16)13-18-8-5-9-23(26)25(18)21/h2-4,6-7,10-12,18-19,21H,5,8-9,13-15H2,1H3/t18-,19+,21+/m1/s1
InChIKey SHSRLZLVIDRDNF-DYXWJJEUSA-N
Molecular Weight 491.369 g/mol
SMILES [C@]1(N2[C@@](C[C@@](C1)(OCc1ccccc1)[H])(CCCC2=O)[H])(c1cc(I)c(cc1)OC)[H]
SPLASH splash10-0006-8000900000-2beeab8afbe19f79c4ce
Source of Spectrum J-52-4671-39
Synonyms (6.alpha.,8.beta.,9a.alpha.)-(+,-)-octahydro-6-(3-iodo-4-methoxyphenyl)-8-(phenylmethoxy)-4H-quinolizin-4-one (6S,8S,9aR)-8-(benzyloxy)-6-(3-iodo-4-methoxyphenyl)octahydro-4H-quinolizin-4-one
Wiley ID 1397385