| SpectraBase Spectrum ID |
1PcacztxV6j |
| Name |
6-Fluoro-8-oxa-tricyclo[9.2.2.2(4,7)]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaen-3-one |
| Appearance |
White solid |
| Carrier Gas |
Helium (1.5 ml/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
256.089957820 u |
| Formula |
C16H13FO2 |
| GC Column |
BPX5 (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C16H13FO2/c17-14-10-13-5-6-16(14)19-8-7-11-1-3-12(4-2-11)9-15(13)18/h1-6,10H,7-9H2 |
| InChIKey |
MIJJMMPIYZQDKP-UHFFFAOYSA-N |
| Inlet Type |
Split (1:10) |
| Instrument Name |
Thermo Fisher Scientific Trace 1310 GC-TSQ 9000 triple quad MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202202577 |
| Molecular Weight |
256.276 g/mol |
| Quality |
686 |
| Reported Formula |
C16H13FO2 |
| SMILES |
C1=C2C=CC(=C1)CC(C1=CC=C(C(=C1)F)OCC2)=O |
| SPLASH |
splash10-014i-2910000000-a4c82ff2f6b0561293a8 |
| Source of Spectrum |
QE-28-SM36-7t (DOI: 10.1002/chem.202202577) |
| Thin-Layer Chromatography |
0.45 (DCM) |
| Wiley ID |
1904359 |
![6-Fluoro-8-oxa-tricyclo[9.2.2.2(4,7)]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaen-3-one](/api/spectrum/1PcacztxV6j/structure.png?h=300&w=458 "6-Fluoro-8-oxa-tricyclo[9.2.2.2(4,7)]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaen-3-one")
