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(1S,2S,5S,6R)-3-Benzyl-2-exo-sec-butyl-6-endo-hydroxymethyl-7,8-dioxa-3-azabicyclo[3.2.1]octane
SpectraBase Compound ID 9HftJ17zTOX
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-/m0/s1
InChIKey LXQPPGVODSTTTG-GARPMUOSSA-N
Mol Weight 291.39 g/mol
Molecular Formula C17H25NO3
Exact Mass 291.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HmpszG9Uxs
Name (1S,2S,5S,6R)-3-Benzyl-2-exo-sec-butyl-6-endo-hydroxymethyl-7,8-dioxa-3-azabicyclo[3.2.1]octane
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-/m0/s1
InChIKey LXQPPGVODSTTTG-GARPMUOSSA-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 splash10-0007-7090000000-816f2c4264200e5b1120
Source of Spectrum F-67-7490-7
Synonyms [(1S,4S,5S,7R)-3-benzyl-4-sec-butyl-6,8-dioxa-3-azabicyclo[3.2.1]oct-7-yl]methanol
Wiley ID 1571047