| SpectraBase Spectrum ID |
DQZe2XUlYzr |
| Name |
Dimethyl [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(nitromethyl)ethyl]malonate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
353.111066568 u |
| Formula |
C16H19NO8 |
| InChI |
InChI=1S/C16H19NO8/c1-22-15(18)14(16(19)23-2)11(9-17(20)21)7-10-3-4-12-13(8-10)25-6-5-24-12/h3-4,8,11,14H,5-7,9H2,1-2H3 |
| InChIKey |
LAKWLWHQYWEXLZ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504593 |
| Molecular Weight |
353.327 g/mol |
| Quality |
181 |
| SMILES |
C1(CC(C(C(OC)=O)C(OC)=O)C[N+]([O-])=O)=CC=C2C(=C1)OCCO2 |
| SPLASH |
splash10-004j-0911000000-4f80b097c7b167d7985e |
| Source of Spectrum |
QE-22-SM10-2i (DOI: 10.1002/chem.201504593) |
| Thin-Layer Chromatography |
0.20 (petroleum ether/diethyl ether, 1:1) |
| Wiley ID |
1902986 |
![Dimethyl [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(nitromethyl)ethyl]malonate](/api/spectrum/DQZe2XUlYzr/structure.png?h=300&w=458 "Dimethyl [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(nitromethyl)ethyl]malonate")
