| SpectraBase Spectrum ID |
B0GZn73cy0m |
| Name |
2-(4-Chlorophenyl)-5-phenylhex-3-yne-2,5-diol |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.091707485 u |
| Formula |
C18H17ClO2 |
| GC Column |
HP-5MS |
| InChI |
InChI=1S/C18H17ClO2/c1-17(20,14-6-4-3-5-7-14)12-13-18(2,21)15-8-10-16(19)11-9-15/h3-11,20-21H,1-2H3 |
| InChIKey |
SDIBFVIBYJINTP-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890N-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201502174 |
| Molecular Weight |
300.785 g/mol |
| Reported Formula |
C18H17O2Cl |
| SMILES |
OC(C#CC(C)(O)C1=CC=C(C=C1)Cl)(C1=CC=CC=C1)C |
| SPLASH |
splash10-03fr-0090000000-ab45e0181882d07de734 |
| Sample Comments |
Mixture of diastereoisomers (1:1) |
| Source of Spectrum |
QE-21-SM21-4e (DOI: 10.1002/chem.201502174) |
| Thin-Layer Chromatography |
0.24 (hexane/AcOEt, 3:1) |
| Wiley ID |
1909254 |
