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(3S)-1,1-Dibenzyl-3-hydroxypyrrolidinium tetrafluoroborate
SpectraBase Compound ID EMfWhxMlLdH
InChI InChI=1S/C18H22NO.BF4/c20-18-11-12-19(15-18,13-16-7-3-1-4-8-16)14-17-9-5-2-6-10-17;2-1(3,4)5/h1-10,18,20H,11-15H2;/q+1;-1/t18-;/m0./s1
InChIKey RAHZJPMVTDJRQJ-FERBBOLQSA-N
Mol Weight 355.18 g/mol
Molecular Formula C18H22BF4NO
Exact Mass 355.173057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWddqCdcJX8
Name (3S)-1,1-Dibenzyl-3-hydroxypyrrolidinium tetrafluoroborate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22BF4NO
InChI InChI=1S/C18H22NO.BF4/c20-18-11-12-19(15-18,13-16-7-3-1-4-8-16)14-17-9-5-2-6-10-17;2-1(3,4)5/h1-10,18,20H,11-15H2;/q+1;-1/t18-;/m0./s1
InChIKey RAHZJPMVTDJRQJ-FERBBOLQSA-N
Instrument Name QMD 1000 Carlo Erba
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.210
Molecular Weight 355.184 g/mol
Optical Rotation [a]D27 = +8.4 (c = 0.79, acetone)
SMILES F[B-](F)(F)F.O[C@@]1(C[N+](Cc2ccccc2)(CC1)Cc1ccccc1)[H]
SPLASH splash10-0006-9020000000-20f3c7e5eba26a957a2b
Source of Spectrum ARK-2014-60-17
Thin-Layer Chromatography Rf = 0.46 (CH2Cl2/MeOH, 10:1)
Wiley ID 1843279