(1R,2S,5R,6S)-3-Benzyl-2-endo-sec-butyl-6-endo-hydroxymethyl-7,8-dioxa-3-azabicyclo[3.2.1]octane

SpectraBase Compound ID	2gF98V2x1FC
InChI	InChI=1S/C17H25NO3/c1-3-12(2)16-17-20-14(15(11-19)21-17)10-18(16)9-13-7-5-4-6-8-13/h4-8,12,14-17,19H,3,9-11H2,1-2H3/t12?,14-,15+,16+,17-/m1/s1
InChIKey	LXQPPGVODSTTTG-NCIRKRJJSA-N Google Search
Mol Weight	291.39 g/mol
Molecular Formula	C17H25NO3
Exact Mass	291.183444 g/mol

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SpectraBase Spectrum ID	2aKvKhsq1o1
Name	(1R,2S,5R,6S)-3-Benzyl-2-endo-sec-butyl-6-endo-hydroxymethyl-7,8-dioxa-3-azabicyclo[3.2.1]octane
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H25NO3
InChI	InChI=1S/C17H25NO3/c1-3-12(2)16-17-20-14(15(11-19)21-17)10-18(16)9-13-7-5-4-6-8-13/h4-8,12,14-17,19H,3,9-11H2,1-2H3/t12?,14-,15+,16+,17-/m1/s1
InChIKey	LXQPPGVODSTTTG-NCIRKRJJSA-N
Molecular Weight	291.391 g/mol
SMILES	OC[C@]1([C@]2(CN([C@]([C@@](O1)(O2)[H])(C(CC)C)[H])Cc1ccccc1)[H])[H]
SPLASH	splash10-0006-9000000000-b56f44dcec9e59543e92
Source of Spectrum	F-67-7490-8
Synonyms	[(1R,4S,5R,7S)-3-benzyl-4-sec-butyl-6,8-dioxa-3-azabicyclo[3.2.1]oct-7-yl]methanol
Wiley ID	1571046