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9-Methoxycarbonyl-1(R)-pentyl-3-phenyl-9-azabicyclo[3.3.1]nonan-3-ol
SpectraBase Compound ID GLDG1yWSH1y
InChI InChI=1S/C21H31NO3/c1-3-4-8-13-20-14-9-12-18(22(20)19(23)25-2)15-21(24,16-20)17-10-6-5-7-11-17/h5-7,10-11,18,24H,3-4,8-9,12-16H2,1-2H3/t18-,20-,21+/m1/s1
InChIKey BKRRDOABWDZCMZ-NRSPTQNISA-N
Mol Weight 345.48 g/mol
Molecular Formula C21H31NO3
Exact Mass 345.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fSr5EhL2bl
Name 9-Methoxycarbonyl-1(R)-pentyl-3-phenyl-9-azabicyclo[3.3.1]nonan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO3
InChI InChI=1S/C21H31NO3/c1-3-4-8-13-20-14-9-12-18(22(20)19(23)25-2)15-21(24,16-20)17-10-6-5-7-11-17/h5-7,10-11,18,24H,3-4,8-9,12-16H2,1-2H3/t18-,20-,21+/m1/s1
InChIKey BKRRDOABWDZCMZ-NRSPTQNISA-N
Molecular Weight 345.483 g/mol
SMILES O[C@]1(C[C@@]2(N([C@@](C1)(CCC2)CCCCC)C(=O)OC)[H])c1ccccc1
SPLASH splash10-05ei-2393000000-10a5f5b6b9f253adb404
Source of Spectrum KC-57-3409-8
Synonyms Methyl (1R)-3-hydroxy-1-pentyl-3-phenyl-9-azabicyclo[3.3.1]nonane-9-carboxylate
Wiley ID 1623808