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2-Propanone, 1,3-bis(octahydro-6-hydroxy-7-methyl-6-phenyl-5-indolizinyl)-, (5.alpha.,6.beta.,7.beta.,8a.alpha.)-[5'R*-(5'.alpha.,6'.beta.,7'.beta.,8'a.alpha.)]-(.+-.)-
SpectraBase Compound ID K5EImUVyPr5
InChI InChI=1S/C33H44N2O3/c1-23-19-27-15-9-17-34(27)30(32(23,37)25-11-5-3-6-12-25)21-29(36)22-31-33(38,26-13-7-4-8-14-26)24(2)20-28-16-10-18-35(28)31/h3-8,11-14,23-24,27-28,30-31,37-38H,9-10,15-22H2,1-2H3
InChIKey JPVGVKCBHJUCQQ-UHFFFAOYSA-N
Mol Weight 516.7 g/mol
Molecular Formula C33H44N2O3
Exact Mass 516.335193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCi86De0RXw
Name 2-Propanone, 1,3-bis(octahydro-6-hydroxy-7-methyl-6-phenyl-5-indolizinyl)-, (5.alpha.,6.beta.,7.beta.,8a.alpha.)-[5'R*-(5'.alpha.,6'.beta.,7'.beta.,8'a.alpha.)]-(.+-.)-
CAS Registry Number 51020-39-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H44N2O3
InChI InChI=1S/C33H44N2O3/c1-23-19-27-15-9-17-34(27)30(32(23,37)25-11-5-3-6-12-25)21-29(36)22-31-33(38,26-13-7-4-8-14-26)24(2)20-28-16-10-18-35(28)31/h3-8,11-14,23-24,27-28,30-31,37-38H,9-10,15-22H2,1-2H3
InChIKey JPVGVKCBHJUCQQ-UHFFFAOYSA-N
Molecular Weight 516.726 g/mol
SMILES OC1(C(CC(CC2N3CCCC3CC(C2(c2ccccc2)O)C)=O)N2CCCC2CC1C)c1ccccc1
SPLASH splash10-001i-3593000000-0ab19d9581b4cec3b600
Source of Spectrum S-27-1912-7
Synonyms 1,3-Bis(6-hydroxy-7-methyl-6-phenyloctahydro-5-indolizinyl)acetone 1,3-bis(6-hydroxy-7-methyl-6-phenyl-2,3,5,7,8,8a-hexahydro-1H-indolizin-5-yl)-2-propanone 1,3-bis(6-hydroxy-7-methyl-6-phenyl-2,3,5,7,8,8a-hexahydro-1H-indolizin-5-yl)propan-2-one 1,3-bis(6-hydroxy-7-methyl-6-phenyl-indolizidin-5-yl)acetone 1,3-bis(7-methyl-6-oxidanyl-6-phenyl-2,3,5,7,8,8a-hexahydro-1H-indolizin-5-yl)propan-2-one Dendrocrepin Dendrocrepine
Wiley ID 1401494