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Diethyl (2R*,4S*)-1-Benzylazetidine-2,4-dicarboxylate
SpectraBase Compound ID 5c5pXg40bEo
InChI InChI=1S/C16H21NO4/c1-3-20-15(18)13-10-14(16(19)21-4-2)17(13)11-12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3/t13-,14+
InChIKey DXLXLBWDINXHBH-OKILXGFUSA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIi7Ut6ovfg
Name Diethyl (2R*,4S*)-1-Benzylazetidine-2,4-dicarboxylate
Alternate Name(s) Diethyl (2R,4S)-1-benzyl-2,4-azetidinedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-3-20-15(18)13-10-14(16(19)21-4-2)17(13)11-12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3/t13-,14+
InChIKey DXLXLBWDINXHBH-OKILXGFUSA-N
Molecular Weight 291.347 g/mol
SMILES [C@@]1(N([C@@](C1)(C(=O)OCC)[H])Cc1ccccc1)(C(=O)OCC)[H]
SPLASH splash10-0006-9130000000-1df3bb7c7a5704078c61
Source of Spectrum KD-12-611-3
Wiley ID 1634264