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(2S,3R)-5-[3-(tert-butylamino)-2-hydroxy-propoxy]tetralin-2,3-diol
SpectraBase Compound ID 9jn92QDZAXa
InChI InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12?,14-,15+/m0/s1
InChIKey VWPOSFSPZNDTMJ-JQXSQYPDSA-N
Mol Weight 309.41 g/mol
Molecular Formula C17H27NO4
Exact Mass 309.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FG902APyPyy
Name (2S,3R)-5-[3-(tert-butylamino)-2-hydroxy-propoxy]tetralin-2,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27NO4
InChI InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12?,14-,15+/m0/s1
InChIKey VWPOSFSPZNDTMJ-JQXSQYPDSA-N
Molecular Weight 309.406 g/mol
SMILES O[C@@]1(Cc2c(OCC(CNC(C)(C)C)O)cccc2C[C@@]1(O)[H])[H]
SPLASH splash10-000i-9010000000-dd4fb575a7418ea8cccc
Source of Spectrum CJ-1992-0-0
Synonyms (2S,3R)-5-[3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol (2S,3R)-5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol
Wiley ID 1310667