| SpectraBase Spectrum ID |
C1FLpxvwzay |
| Name |
6-Cyclopropyl-2-methyl-6-(1-methyl-1H-indol-3-yl)-3,6-diphenylhex-4-yn-3-ol |
| Appearance |
White foam |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
433.240564621 u |
| Formula |
C31H31NO |
| GC Column |
HP-5MS |
| InChI |
InChI=1S/C31H31NO/c1-23(2)31(33,26-14-8-5-9-15-26)21-20-30(25-18-19-25,24-12-6-4-7-13-24)28-22-32(3)29-17-11-10-16-27(28)29/h4-17,22-23,25,33H,18-19H2,1-3H3 |
| InChIKey |
ROLFTWWATBXULZ-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201502174 |
| Molecular Weight |
433.595 g/mol |
| Quality |
4 |
| Reported Formula |
C31H31NO |
| SMILES |
OC(C#CC(C=1C=2C=CC=CC2N(C1)C)(C1CC1)C1=CC=CC=C1)(C(C)C)C1=CC=CC=C1 |
| SPLASH |
splash10-0159-0340900000-47e7380461f3366be4a0 |
| Sample Comments |
Mixture of diastereoisomers (1:1) |
| Source of Spectrum |
QE-21-SM3-1c (DOI: 10.1002/chem.201502174) |
| Thin-Layer Chromatography |
0.33 (hexane/Et2O, 2:1) |
| Wiley ID |
1909225 |
