| SpectraBase Spectrum ID |
KNngWSsiSsi |
| Name |
4-((2-fluorophenyl)ethynyl)-1-methoxy-2-methylbenzene |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.095043201 u |
| Formula |
C16H13FO |
| InChI |
InChI=1S/C16H13FO/c1-12-11-13(8-10-16(12)18-2)7-9-14-5-3-4-6-15(14)17/h3-6,8,10-11H,1-2H3 |
| InChIKey |
QOCHLSHAHGQHKO-UHFFFAOYSA-N |
| Instrument Name |
Joel JMS-700 or Bruker ApexQe hybrid 9.4 FT-ICR |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201805918 |
| Molecular Weight |
240.277 g/mol |
| Reported Formula |
C16H13FO |
| SMILES |
C1(F)=C(C=CC=C1)C#CC1=CC(=C(C=C1)OC)C |
| SPLASH |
splash10-002f-0190000000-51415c8ee779825584b1 |
| Source of Spectrum |
ACI-57-SM9-1d (DOI: 10.1002/anie.201805918) |
| Thin-Layer Chromatography |
0.53 (PE/EA, 10:1) |
| Wiley ID |
1893452 |
