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(4R,5R)-4-Fluoro-5-methyl-5-phenylpyrrolidin-2-one
SpectraBase Compound ID Dsvg2UpoZWf
InChI InChI=1S/C11H12FNO/c1-11(8-5-3-2-4-6-8)9(12)7-10(14)13-11/h2-6,9H,7H2,1H3,(H,13,14)/t9-,11-/m1/s1
InChIKey LAUACNJRONZATO-MWLCHTKSSA-N
Mol Weight 193.22 g/mol
Molecular Formula C11H12FNO
Exact Mass 193.090292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KBkgwwXm2e
Name (4R,5R)-4-Fluoro-5-methyl-5-phenylpyrrolidin-2-one
Appearance Yellow semi-solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 193.090292172 u
Formula C11H12FNO
InChI InChI=1S/C11H12FNO/c1-11(8-5-3-2-4-6-8)9(12)7-10(14)13-11/h2-6,9H,7H2,1H3,(H,13,14)/t9-,11-/m1/s1
InChIKey LAUACNJRONZATO-MWLCHTKSSA-N
Instrument Name Thermo Finnigan Polaris Q
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900685
Molecular Weight 193.221 g/mol
Optical Rotation [a]D26 = -177.4 (c = 1.0, CHCl3)
Quality 144
Reported Formula C11H12FNO
SMILES N1[C@@]([C@@](CC1=O)(F)[H])(C1=CC=CC=C1)C
SPLASH splash10-004i-0900000000-a53edc1fd07934e8a3fc
Source of Spectrum K1-2019-4718-(4R,5R)-2k (DOI: 10.1002/ejoc.201900685)
Wiley ID 1891968