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(2R,3S,4S,5R)-2,5-Bis(1-pyrrolidinyl)-1,6-diphenyl-3,4-hexanediol
SpectraBase Compound ID 4o3IIWNHEoL
InChI InChI=1S/C26H36N2O2/c29-25(23(27-15-7-8-16-27)19-21-11-3-1-4-12-21)26(30)24(28-17-9-10-18-28)20-22-13-5-2-6-14-22/h1-6,11-14,23-26,29-30H,7-10,15-20H2/t23-,24-,25+,26+/m1/s1
InChIKey PGQWUYVGIKJAMT-XPGKHFPBSA-N
Mol Weight 408.6 g/mol
Molecular Formula C26H36N2O2
Exact Mass 408.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gqlPhE9Lq9
Name (2R,3S,4S,5R)-2,5-Bis(1-pyrrolidinyl)-1,6-diphenyl-3,4-hexanediol
Alternate Name(s) 1,2,5,6-tetradeoxy-1,6-diphenyl-2,5-di(1-pyrrolidinyl)-D-iditol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36N2O2
InChI InChI=1S/C26H36N2O2/c29-25(23(27-15-7-8-16-27)19-21-11-3-1-4-12-21)26(30)24(28-17-9-10-18-28)20-22-13-5-2-6-14-22/h1-6,11-14,23-26,29-30H,7-10,15-20H2/t23-,24-,25+,26+/m1/s1
InChIKey PGQWUYVGIKJAMT-XPGKHFPBSA-N
Molecular Weight 408.586 g/mol
SMILES O[C@]([C@]([C@](N1CCCC1)(Cc1ccccc1)[H])(O)[H])([C@](N1CCCC1)(Cc1ccccc1)[H])[H]
SPLASH splash10-05fr-0910700000-732d412809e8ee13ee5e
Source of Spectrum QC-11-3127-4
Wiley ID 859996