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(1R,2S,3S,4R)-1,4-Diamino1,4-dibenzyl-2,3-butanediol isopropylidene acetal
SpectraBase Compound ID PI47uUyQNB
InChI InChI=1S/C21H28N2O2/c1-21(2)24-19(17(22)13-15-9-5-3-6-10-15)20(25-21)18(23)14-16-11-7-4-8-12-16/h3-12,17-20H,13-14,22-23H2,1-2H3/t17-,18-,19+,20+/m1/s1
InChIKey DWYGCNIREGQVDY-ZRNYENFQSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1enXjxqgXKS
Name (1R,2S,3S,4R)-1,4-Diamino1,4-dibenzyl-2,3-butanediol isopropylidene acetal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-21(2)24-19(17(22)13-15-9-5-3-6-10-15)20(25-21)18(23)14-16-11-7-4-8-12-16/h3-12,17-20H,13-14,22-23H2,1-2H3/t17-,18-,19+,20+/m1/s1
InChIKey DWYGCNIREGQVDY-ZRNYENFQSA-N
Molecular Weight 340.467 g/mol
SMILES N[C@@]([C@]1([C@]([C@@](Cc2ccccc2)(N)[H])(OC(O1)(C)C)[H])[H])(Cc1ccccc1)[H]
SPLASH splash10-006x-4639000000-efc08bbbbae4595cf136
Source of Spectrum QC-11-3128-10
Synonyms (1R)-1-[(4S,5S)-5-[(1R)-1-amino-2-phenylethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylethanamine (1R)-1-[(4S,5S)-5-[(1R)-1-amino-2-phenyl-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenyl-ethanamine (1R)-1-[(4S,5S)-5-[(1R)-1-azanyl-2-phenyl-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenyl-ethanamine
Wiley ID 859993