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(3R,4S,1'S)-4-Benzoyloxymethyl-3-hydroxy-1-(1'-phenylethyl)pyrrolidin-2-one
SpectraBase Compound ID 2jNgA6w5Y2y
InChI InChI=1S/C20H21NO4/c1-14(15-8-4-2-5-9-15)21-12-17(18(22)19(21)23)13-25-20(24)16-10-6-3-7-11-16/h2-11,14,17-18,22H,12-13H2,1H3/t14-,17-,18+/m0/s1
InChIKey CXCKFKQHFXXYAM-JCGIZDLHSA-N
Mol Weight 339.39 g/mol
Molecular Formula C20H21NO4
Exact Mass 339.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9x4L2Kmwrn1
Name (3R,4S,1'S)-4-Benzoyloxymethyl-3-hydroxy-1-(1'-phenylethyl)pyrrolidin-2-one
Alternate Name(s) {(3S,4R)-4-hydroxy-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidinyl}methyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4
InChI InChI=1S/C20H21NO4/c1-14(15-8-4-2-5-9-15)21-12-17(18(22)19(21)23)13-25-20(24)16-10-6-3-7-11-16/h2-11,14,17-18,22H,12-13H2,1H3/t14-,17-,18+/m0/s1
InChIKey CXCKFKQHFXXYAM-JCGIZDLHSA-N
Molecular Weight 339.391 g/mol
SMILES O[C@]1(C(N(C[C@]1(COC(=O)c1ccccc1)[H])[C@](c1ccccc1)(C)[H])=O)[H]
SPLASH splash10-0006-9200000000-18743a13373bd77d4d41
Source of Spectrum KD-16-1782-12
Wiley ID 1637672