| SpectraBase Spectrum ID |
GXDVyve6LUe |
| Name |
1,1-Dimethyl-3-(4-nitrophenyl)-1H-isoindole 2-Oxide |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.100442316 u |
| Formula |
C16H14N2O3 |
| InChI |
InChI=1S/C16H14N2O3/c1-16(2)14-6-4-3-5-13(14)15(17(16)19)11-7-9-12(10-8-11)18(20)21/h3-10H,1-2H3 |
| InChIKey |
VJCXURIJRIIUHT-UHFFFAOYSA-N |
| Instrument Name |
Waters AutoSpec Premier |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02797 |
| Molecular Weight |
282.299 g/mol |
| Reported Formula |
C16H14N2O3 |
| SMILES |
C1=CC=CC2=C1C([N+](=C2C=1C=CC(=CC1)[N+]([O-])=O)[O-])(C)C |
| SPLASH |
splash10-001i-0090000000-7c704c3bcf23224930af |
| Source of Spectrum |
JOC-88-2389-2l (DOI: 10.1021/acs.joc.2c02797) |
| Thin-Layer Chromatography |
0.32 (Hexane/EtOAc, 2:1) |
| Wiley ID |
1912638 |
