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(S,S,R)-tert-Butyl 2-[.alpha.-N-(2-methoxymethylpyrrolidin-1-yl)aminobenzyl]pentanoate
SpectraBase Compound ID 8vHzqJZSMI0
InChI InChI=1S/C22H36N2O3/c1-6-11-19(21(25)27-22(2,3)4)20(17-12-8-7-9-13-17)23-24-15-10-14-18(24)16-26-5/h7-9,12-13,18-20,23H,6,10-11,14-16H2,1-5H3/t18-,19-,20-/m0/s1
InChIKey DPLGDJXAHJKLPY-UFYCRDLUSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H36N2O3
Exact Mass 376.272593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uGNGaLMsJy
Name (S,S,R)-tert-Butyl 2-[.alpha.-N-(2-methoxymethylpyrrolidin-1-yl)aminobenzyl]pentanoate
Alternate Name(s) tert-Butyl (2S)-2-[(R)-{[(2S)-2-(methoxymethyl)pyrrolidinyl]amino}(phenyl)methyl]pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O3
InChI InChI=1S/C22H36N2O3/c1-6-11-19(21(25)27-22(2,3)4)20(17-12-8-7-9-13-17)23-24-15-10-14-18(24)16-26-5/h7-9,12-13,18-20,23H,6,10-11,14-16H2,1-5H3/t18-,19-,20-/m0/s1
InChIKey DPLGDJXAHJKLPY-UFYCRDLUSA-N
Molecular Weight 376.541 g/mol
SMILES N(N1[C@](COC)(CCC1)[H])[C@]([C@@](C(OC(C)(C)C)=O)(CCC)[H])(c1ccccc1)[H]
SPLASH splash10-004i-1901000000-b391137a46b01aa81f3a
Source of Spectrum SO-0-1324-3
Wiley ID 1545354