| SpectraBase Spectrum ID |
IpoWa2T5UK9 |
| Name |
tert-butyl 3,4-difluoro-2-(phenylethynyl)benzoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.111836079 u |
| Formula |
C19H16F2O2 |
| InChI |
InChI=1S/C19H16F2O2/c1-19(2,3)23-18(22)15-11-12-16(20)17(21)14(15)10-9-13-7-5-4-6-8-13/h4-8,11-12H,1-3H3 |
| InChIKey |
QDFYPYPRMJTYHI-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202206176 |
| Molecular Weight |
314.332 g/mol |
| Reported Formula |
C19H16F2O2 |
| SMILES |
C1(=C(C#CC2=CC=CC=C2)C(C(OC(C)(C)C)=O)=CC=C1F)F |
| SPLASH |
splash10-0a4i-0090000000-799623a1dff0fa10a5f8 |
| Source of Spectrum |
ACI-61-SM37-9s (DOI: 10.1002/anie.202206176) |
| Wiley ID |
1897762 |
