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(3R,4R)-1-benzyl-3-hydroxy-isonipecotic acid ethyl ester
SpectraBase Compound ID 880T7KnGAq
InChI InChI=1S/C15H21NO3/c1-2-19-15(18)13-8-9-16(11-14(13)17)10-12-6-4-3-5-7-12/h3-7,13-14,17H,2,8-11H2,1H3/t13-,14+/m1/s1
InChIKey XEPZKCVKBIJDII-KGLIPLIRSA-N
Mol Weight 263.34 g/mol
Molecular Formula C15H21NO3
Exact Mass 263.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvLyQouCSEg
Name (3R,4R)-1-benzyl-3-hydroxy-isonipecotic acid ethyl ester
CAS Registry Number 115753-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO3
InChI InChI=1S/C15H21NO3/c1-2-19-15(18)13-8-9-16(11-14(13)17)10-12-6-4-3-5-7-12/h3-7,13-14,17H,2,8-11H2,1H3/t13-,14+/m1/s1
InChIKey XEPZKCVKBIJDII-KGLIPLIRSA-N
Molecular Weight 263.337 g/mol
SMILES O[C@]1(CN(CC[C@]1(C(=O)OCC)[H])Cc1ccccc1)[H]
SPLASH splash10-006x-9630000000-d60e2ce7388e38934ff4
Source of Spectrum KD-15-3286-11
Synonyms (3R,4R)-3-hydroxy-1-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester Ethyl (3R,4R)-1-benzyl-3-hydroxy-piperidine-4-carboxylate Ethyl (3R,4R)-3-oxidanyl-1-(phenylmethyl)piperidine-4-carboxylate
Wiley ID 1637250