| SpectraBase Spectrum ID |
5htJ0Kr5fve |
| Name |
Dimethyl [2-(1-benzofuran-2-yl)-1-(nitromethyl)ethyl]malonate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
335.100501884 u |
| Formula |
C16H17NO7 |
| InChI |
InChI=1S/C16H17NO7/c1-22-15(18)14(16(19)23-2)11(9-17(20)21)8-12-7-10-5-3-4-6-13(10)24-12/h3-7,11,14H,8-9H2,1-2H3 |
| InChIKey |
OCPLSFXGLPIXQJ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504593 |
| Molecular Weight |
335.312 g/mol |
| Quality |
78 |
| SMILES |
C=1(CC(C(C(OC)=O)C(OC)=O)C[N+]([O-])=O)OC2=C(C1)C=CC=C2 |
| SPLASH |
splash10-0a59-0900000000-978b1071c3aae52e40b4 |
| Source of Spectrum |
QE-22-SM13-2n (DOI: 10.1002/chem.201504593) |
| Thin-Layer Chromatography |
0.45 (petroleum ether/diethyl ether, 1:1) |
| Wiley ID |
1902989 |
![Dimethyl [2-(1-benzofuran-2-yl)-1-(nitromethyl)ethyl]malonate](/api/spectrum/5htJ0Kr5fve/structure.png?h=300&w=458 "Dimethyl [2-(1-benzofuran-2-yl)-1-(nitromethyl)ethyl]malonate")
