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(2R,4S)-1-ethyl-4-(4-methoxyphenyl)-2-phenyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID 20uqcIyqCgN
InChI InChI=1S/C24H25NO/c1-3-25-23-12-8-7-11-21(23)22(18-13-15-20(26-2)16-14-18)17-24(25)19-9-5-4-6-10-19/h4-16,22,24H,3,17H2,1-2H3/t22-,24+/m0/s1
InChIKey JWYPWSQVZVHIGB-LADGPHEKSA-N
Mol Weight 343.47 g/mol
Molecular Formula C24H25NO
Exact Mass 343.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COQ1majdDAe
Name (2R,4S)-1-ethyl-4-(4-methoxyphenyl)-2-phenyl-1,2,3,4-tetrahydroquinoline
Appearance Colorless gum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO
InChI InChI=1S/C24H25NO/c1-3-25-23-12-8-7-11-21(23)22(18-13-15-20(26-2)16-14-18)17-24(25)19-9-5-4-6-10-19/h4-16,22,24H,3,17H2,1-2H3/t22-,24+/m0/s1
InChIKey JWYPWSQVZVHIGB-LADGPHEKSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800677
Molecular Weight 343.470 g/mol
Optical Rotation [a]D(RT) = +71.5 (c = 1.0, CH2Cl2)
SMILES C(C)N1[C@](C[C@](C2=C1C=CC=C2)(C1=CC=C(C=C1)OC)[H])(C1=CC=CC=C1)[H]
SPLASH splash10-0006-0049000000-827170c0872b27c549dd
Sample Comments 88% ee
Source of Spectrum QE-24-SM4-3b (DOI: 10.1002/chem.201800677)
Wiley ID 1901502