SpectraBase Spectrum ID |
AqI1RNqoF0t |
Name |
(S)-(+)-N-Benzyl-2-{[(N-methylbenzyl)amino]methyl}-2-(trifluoromethyl)pyrrolidine |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H25F3N2 |
InChI |
InChI=1S/C21H25F3N2/c1-17(19-11-6-3-7-12-19)25-16-20(21(22,23)24)13-8-14-26(20)15-18-9-4-2-5-10-18/h2-7,9-12,17,25H,8,13-16H2,1H3/t17-,20?/m0/s1 |
InChIKey |
AZNMCWHGVRSIKG-DIMJTDRSSA-N |
Instrument Name |
Shimadzu GCMS-QP 2010S |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201502084 |
Molecular Weight |
362.440 g/mol |
Optical Rotation |
[a]D20 = +26 (c = 0.8, CHCl3) |
Quality |
139 |
Reported Formula |
C21H25F3N2 |
SMILES |
N(CC1(CCCN1CC1=CC=CC=C1)C(F)(F)F)[C@@](C)(C1=CC=CC=C1)[H] |
SPLASH |
splash10-0a4l-9540000000-85eb0fd42c6c5479b0cb |
Source of Spectrum |
QE-21-SM19-(+)-9b (DOI: 10.1002/chem.201502084) |
Wiley ID |
1906914 |