| SpectraBase Spectrum ID |
1l2FmlHVvu5 |
| Name |
4,4-Dimethyl-2-(3-(thiophen-2-yl)-3'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-4,5-dihydrooxazole |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.106119866 u |
| Formula |
C22H18F3NOS |
| InChI |
InChI=1S/C22H18F3NOS/c1-21(2)13-27-20(26-21)19-16(8-4-9-17(19)18-10-5-11-28-18)14-6-3-7-15(12-14)22(23,24)25/h3-12H,13H2,1-2H3 |
| InChIKey |
XKYCLIRIZGQNCR-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202103700 |
| Molecular Weight |
401.447 g/mol |
| Reported Formula |
C22H18F3NOS |
| SMILES |
C1(N=C(OC1)C=1C(C2=CC=CS2)=CC=CC1C=1C=C(C(F)(F)F)C=CC1)(C)C |
| SPLASH |
splash10-0ufr-0049800000-7efcbe0a8e0708ac2c5a |
| Source of Spectrum |
QE-28-SM44-3c (DOI: 10.1002/chem.202103700) |
| Wiley ID |
1898225 |
![4,4-Dimethyl-2-(3-(thiophen-2-yl)-3'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-4,5-dihydrooxazole](/api/spectrum/1l2FmlHVvu5/structure.png?h=300&w=458 "4,4-Dimethyl-2-(3-(thiophen-2-yl)-3'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-4,5-dihydrooxazole")
