SpectraBase Spectrum ID |
BUWHcxw0K5X |
Name |
3-(trifluoromethyl)benzyl 1H-pyrrole-2-carboxylate |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H10F3NO2 |
InChI |
InChI=1S/C13H10F3NO2/c14-13(15,16)10-4-1-3-9(7-10)8-19-12(18)11-5-2-6-17-11/h1-7,17H,8H2 |
InChIKey |
RKQSCABWZBREMS-UHFFFAOYSA-N |
Instrument Name |
Agilent 7250 |
Ionization Type |
EI |
Literature Reference DOI |
10.1016/j.jscs.2023.101600 |
Molecular Weight |
269.223 g/mol |
Quality |
330 |
Reported Formula |
C13H10F3NO2 |
SMILES |
N1C(=CC=C1)C(OCC1=CC(=CC=C1)C(F)(F)F)=O |
SPLASH |
splash10-0aou-6940000000-24af9e8e739e1aeafd56 |
Source of Spectrum |
SCS-27-SM63-3j (DOI: 10.1016/j.jscs.2023.101600) |
Thin-Layer Chromatography |
0.33 (DCM/PE, 7:1) |
Wiley ID |
1911747 |