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(5R*,6S*,8R*)-6-Benzyloxymethyl-8-[3-(phenylsulfonylpropyl]-7-oxa-1-azabicyclo[3.2.1]octane
SpectraBase Compound ID 4Wi3pQEPGBL
InChI InChI=1S/C23H29NO4S/c25-29(26,20-11-5-2-6-12-20)16-8-14-22-21-13-7-15-24(22)28-23(21)18-27-17-19-9-3-1-4-10-19/h1-6,9-12,21-23H,7-8,13-18H2/t21-,22-,23+/m1/s1
InChIKey TVIKDIOMUQRWPP-ZLNRFVROSA-N
Mol Weight 415.55 g/mol
Molecular Formula C23H29NO4S
Exact Mass 415.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrwyyjnY0c0
Name (5R*,6S*,8R*)-6-Benzyloxymethyl-8-[3-(phenylsulfonylpropyl]-7-oxa-1-azabicyclo[3.2.1]octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO4S
InChI InChI=1S/C23H29NO4S/c25-29(26,20-11-5-2-6-12-20)16-8-14-22-21-13-7-15-24(22)28-23(21)18-27-17-19-9-3-1-4-10-19/h1-6,9-12,21-23H,7-8,13-18H2/t21-,22-,23+/m1/s1
InChIKey TVIKDIOMUQRWPP-ZLNRFVROSA-N
Molecular Weight 415.548 g/mol
SMILES [C@@]1(ON2[C@@]([C@]1(CCC2)[H])(CCCS(=O)(=O)c1ccccc1)[H])(COCc1ccccc1)[H]
SPLASH splash10-002f-9010000000-790d503a21d09c095a98
Source of Spectrum KC-1992-1095-24
Synonyms (R)-8-(3-Benzenesulfonyl-propyl)-6-benzyloxymethyl-7-oxa-1-aza-bicyclo[3.2.1]octane
Wiley ID 776404