SpectraBase Spectrum ID |
LfDTc4EU9rr |
Name |
(S)-1-Benzyl-2-[1-(p-tolyl)ethyl]-1H-indole-3-carbaldehyde |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
353.177964364 u |
Formula |
C25H23NO |
InChI |
InChI=1S/C25H23NO/c1-18-12-14-21(15-13-18)19(2)25-23(17-27)22-10-6-7-11-24(22)26(25)16-20-8-4-3-5-9-20/h3-15,17,19H,16H2,1-2H3/t19-/m0/s1 |
InChIKey |
NTIXXONKHKLBDJ-IBGZPJMESA-N |
Instrument Name |
Jeol AccuTOF |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201709075 |
Molecular Weight |
353.465 g/mol |
Optical Rotation |
[a]D23 = -51.3 (c = 1.33, CHCl3) |
Quality |
87 |
Reported Formula |
C25H23NO |
SMILES |
C1=CC=CC2=C1C(=C(N2CC1=CC=CC=C1)[C@@](C)(C=1C=CC(=CC1)C)[H])C=O |
SPLASH |
splash10-0f7o-9658000000-cef60f1e4706a0ca9af7 |
Sample Comments |
er = 90:10 |
Source of Spectrum |
ACI-56-SM70-5l (DOI: 10.1002/anie.201709075) |
Wiley ID |
1896497 |