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(2R,3S,6S)-1-Benzoyl-2-[(3R)-3-hydroxypentyl]-6-propylpiperidin-3-ol
SpectraBase Compound ID 7C1Jg8M7PSU
InChI InChI=1S/C20H31NO3/c1-3-8-16-11-14-19(23)18(13-12-17(22)4-2)21(16)20(24)15-9-6-5-7-10-15/h5-7,9-10,16-19,22-23H,3-4,8,11-14H2,1-2H3/t16-,17+,18+,19-/m0/s1
InChIKey BHVLLBQXFNYPBI-MANSERQUSA-N
Mol Weight 333.47 g/mol
Molecular Formula C20H31NO3
Exact Mass 333.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LW2IaZzp1Y
Name (2R,3S,6S)-1-Benzoyl-2-[(3R)-3-hydroxypentyl]-6-propylpiperidin-3-ol
Alternate Name(s) (2R,3S,6S)-1-benzoyl-2-[(3R)-3-hydroxypentyl]-6-propyl-3-piperidinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO3
InChI InChI=1S/C20H31NO3/c1-3-8-16-11-14-19(23)18(13-12-17(22)4-2)21(16)20(24)15-9-6-5-7-10-15/h5-7,9-10,16-19,22-23H,3-4,8,11-14H2,1-2H3/t16-,17+,18+,19-/m0/s1
InChIKey BHVLLBQXFNYPBI-MANSERQUSA-N
Molecular Weight 333.472 g/mol
SMILES O[C@@](CC[C@@]1([C@](CC[C@@](N1C(=O)c1ccccc1)(CCC)[H])(O)[H])[H])(CC)[H]
SPLASH splash10-0a4i-2910000000-45c8724aeacc344d63e3
Source of Spectrum KC-0-1121-30
Wiley ID 785673