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[(1R*,4S*,5S*)-3-Benzyloxymethyl-2-(4-methylbenzenesulfonyl)-2-azabicyclo[3.1.0]hex-1-yl]ethanol
SpectraBase Compound ID 4VTXrZd5JPY
InChI InChI=1S/C22H27NO4S/c1-17-7-9-21(10-8-17)28(25,26)23-20(13-19-14-22(19,23)11-12-24)16-27-15-18-5-3-2-4-6-18/h2-10,19-20,24H,11-16H2,1H3/t19-,20?,22-/m0/s1
InChIKey ARKZZVBOGXNCNU-DJJOMLBWSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65Fo6qWOrPJ
Name [(1R*,4S*,5S*)-3-Benzyloxymethyl-2-(4-methylbenzenesulfonyl)-2-azabicyclo[3.1.0]hex-1-yl]ethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4S
InChI InChI=1S/C22H27NO4S/c1-17-7-9-21(10-8-17)28(25,26)23-20(13-19-14-22(19,23)11-12-24)16-27-15-18-5-3-2-4-6-18/h2-10,19-20,24H,11-16H2,1H3/t19-,20?,22-/m0/s1
InChIKey ARKZZVBOGXNCNU-DJJOMLBWSA-N
Molecular Weight 401.521 g/mol
SMILES OCC[C@]12N(S(c3ccc(cc3)C)(=O)=O)C(COCc3ccccc3)C[C@@]2([H])C1
SPLASH splash10-0007-9350000000-8fd32f7aeef2902d3cd7
Source of Spectrum F-65-1830-74
Wiley ID 1681659