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Methyl [3R,5R,5(1S]-N-Benzyl-5-[1-(benzyloxy)pentyl]isoxazolidine-3-carboxylate
SpectraBase Compound ID 9Mxm7lMRjvA
InChI InChI=1S/C24H31NO4/c1-3-4-15-22(28-18-20-13-9-6-10-14-20)23-16-21(24(26)27-2)25(29-23)17-19-11-7-5-8-12-19/h5-14,21-23H,3-4,15-18H2,1-2H3/t21-,22+,23-/m1/s1
InChIKey JAXRXAJQDFTDEO-XPWALMASSA-N
Mol Weight 397.52 g/mol
Molecular Formula C24H31NO4
Exact Mass 397.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jNmuU7ipVc
Name Methyl [3R,5R,5(1S]-N-Benzyl-5-[1-(benzyloxy)pentyl]isoxazolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO4
InChI InChI=1S/C24H31NO4/c1-3-4-15-22(28-18-20-13-9-6-10-14-20)23-16-21(24(26)27-2)25(29-23)17-19-11-7-5-8-12-19/h5-14,21-23H,3-4,15-18H2,1-2H3/t21-,22+,23-/m1/s1
InChIKey JAXRXAJQDFTDEO-XPWALMASSA-N
Molecular Weight 397.515 g/mol
SMILES [C@@]1(N(O[C@](C1)([C@@](OCc1ccccc1)(CCCC)[H])[H])Cc1ccccc1)(C(=O)OC)[H]
SPLASH splash10-000l-6529000000-d0f5845bc4471640f15c
Source of Spectrum F-47-9339-10
Synonyms Methyl (3R,5R)-2-benzyl-5-[1-(benzyloxy)pentyl]-3-isoxazolidinecarboxylate
Wiley ID 1368059