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trans-Ethyl 2-phenyl-3-(4'-bromobutanoyloxy)-1-pyrrolidine-5-carboxylate
SpectraBase Compound ID BCsMKZ1qLYM
InChI InChI=1S/C17H20BrNO4/c1-2-22-17(21)13-11-14(23-15(20)9-6-10-18)16(19-13)12-7-4-3-5-8-12/h3-5,7-8,13-14H,2,6,9-11H2,1H3/t13-,14+/m0/s1
InChIKey PFIAWTZRMPINLJ-UONOGXRCSA-N
Mol Weight 382.25 g/mol
Molecular Formula C17H20BrNO4
Exact Mass 381.057571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8QlZsAo75y
Name trans-Ethyl 2-phenyl-3-(4'-bromobutanoyloxy)-1-pyrrolidine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20BrNO4
InChI InChI=1S/C17H20BrNO4/c1-2-22-17(21)13-11-14(23-15(20)9-6-10-18)16(19-13)12-7-4-3-5-8-12/h3-5,7-8,13-14H,2,6,9-11H2,1H3/t13-,14+/m0/s1
InChIKey PFIAWTZRMPINLJ-UONOGXRCSA-N
Molecular Weight 382.254 g/mol
SMILES C1(=N[C@@](C[C@]1(OC(=O)CCCBr)[H])(C(=O)OCC)[H])c1ccccc1
SPLASH splash10-0gbc-0910000000-d72df66b837a4a4f9d0d
Source of Spectrum F-56-1896-20
Synonyms (2S,4R)-4-(4-Bromo-butyryloxy)-5-phenyl-3,4-dihydro-2H-pyrrole-2-carboxylic acid ethyl ester
Wiley ID 856271