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(2S,3S,5S)-N-[(tert-butoxycarbonyl)]-2-benzyl-3-hydroxy-5-nonyl-pyrrolidine
SpectraBase Compound ID BMFyGNdD31h
InChI InChI=1S/C25H41NO3/c1-5-6-7-8-9-10-14-17-21-19-23(27)22(18-20-15-12-11-13-16-20)26(21)24(28)29-25(2,3)4/h11-13,15-16,21-23,27H,5-10,14,17-19H2,1-4H3/t21-,22-,23-/m0/s1
InChIKey KULFLGJMCYQKLC-VABKMULXSA-N
Mol Weight 403.6 g/mol
Molecular Formula C25H41NO3
Exact Mass 403.308644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eQeo9IynpM
Name (2S,3S,5S)-N-[(tert-butoxycarbonyl)]-2-benzyl-3-hydroxy-5-nonyl-pyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H41NO3
InChI InChI=1S/C25H41NO3/c1-5-6-7-8-9-10-14-17-21-19-23(27)22(18-20-15-12-11-13-16-20)26(21)24(28)29-25(2,3)4/h11-13,15-16,21-23,27H,5-10,14,17-19H2,1-4H3/t21-,22-,23-/m0/s1
InChIKey KULFLGJMCYQKLC-VABKMULXSA-N
Literature Reference DOI 10.1002/cjoc.19980160513
Molecular Weight 403.607 g/mol
SMILES O[C@@]1([C@](Cc2ccccc2)(N(C(OC(C)(C)C)=O)[C@@](CCCCCCCCC)(C1)[H])[H])[H]
SPLASH splash10-0bt9-4090000000-97bb565d78e71994ee54
Source of Spectrum CJC-16-466-15b
Synonyms (2S,3S,5S)-tert-butyl 2-benzyl-3-hydroxy-5-nonylpyrrolidine-1-carboxylate
Wiley ID 1773367