For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2R,3S)-1-Benzyl-3-(4-fluorophenyl)pyroglutamic acid
SpectraBase Compound ID BQEYQU56cVE
InChI InChI=1S/C18H16FNO3/c19-14-8-6-13(7-9-14)15-10-16(21)20(17(15)18(22)23)11-12-4-2-1-3-5-12/h1-9,15,17H,10-11H2,(H,22,23)/t15-,17+/m0/s1
InChIKey CYWLKLWWVUNKSJ-DOTOQJQBSA-N
Mol Weight 313.33 g/mol
Molecular Formula C18H16FNO3
Exact Mass 313.111422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BcuoGG2620n
Name (2R,3S)-1-Benzyl-3-(4-fluorophenyl)pyroglutamic acid
Alternate Name(s) (2R,3S)-1-benzyl-3-(4-fluorophenyl)-5-oxo-2-pyrrolidinecarboxylic acid 1-Benzyl-3-(4-fluorophenyl)pyroglutamic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16FNO3
InChI InChI=1S/C18H16FNO3/c19-14-8-6-13(7-9-14)15-10-16(21)20(17(15)18(22)23)11-12-4-2-1-3-5-12/h1-9,15,17H,10-11H2,(H,22,23)/t15-,17+/m0/s1
InChIKey CYWLKLWWVUNKSJ-DOTOQJQBSA-N
Molecular Weight 313.328 g/mol
SMILES OC([C@@]1(N(C(C[C@]1(c1ccc(cc1)F)[H])=O)Cc1ccccc1)[H])=O
SPLASH splash10-0006-9010000000-05305a4f7d483e099390
Source of Spectrum C5-2004-845-10
Wiley ID 1616875