| SpectraBase Spectrum ID |
9tNbmaPHp4z |
| Name |
ethyl 5-((4-bromophenyl)(4-fluorophenyl)methyl)thiophene-2-carboxylate |
| Appearance |
Waxy oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.003842090 u |
| Formula |
C20H16BrFO2S |
| InChI |
InChI=1S/C20H16BrFO2S/c1-2-24-20(23)18-12-11-17(25-18)19(13-3-7-15(21)8-4-13)14-5-9-16(22)10-6-14/h3-12,19H,2H2,1H3 |
| InChIKey |
VNSZYFYWOOGEEM-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101682 |
| Molecular Weight |
419.308 g/mol |
| Reported Formula |
C20H16BrFO2S |
| SMILES |
C1(C(C2=CC=C(C=C2)F)C=2SC(=CC2)C(=O)OCC)=CC=C(C=C1)Br |
| SPLASH |
splash10-00l2-0249200000-672722079cb6d523ffad |
| Source of Spectrum |
ACI-60-SM25-5m (DOI: 10.1002/anie.202101682) |
| Wiley ID |
1891261 |
