| SpectraBase Spectrum ID |
9oj9D2xq2CY |
| Name |
Dimethyl [2-nitro-1-(2-thienylmethyl)ethyl]malonate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO6S |
| InChI |
InChI=1S/C12H15NO6S/c1-18-11(14)10(12(15)19-2)8(7-13(16)17)6-9-4-3-5-20-9/h3-5,8,10H,6-7H2,1-2H3 |
| InChIKey |
UQSRFECNLSDDPA-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504593 |
| Molecular Weight |
301.313 g/mol |
| Quality |
117 |
| SMILES |
C=1(CC(C(C(OC)=O)C(OC)=O)C[N+]([O-])=O)SC=CC1 |
| SPLASH |
splash10-00dj-3900000000-fa91775523c50396b54c |
| Source of Spectrum |
QE-22-SM12-2l (DOI: 10.1002/chem.201504593) |
| Thin-Layer Chromatography |
0.62 (petroleum ether/diethyl ether, 1:1) |
| Wiley ID |
1902987 |
![Dimethyl [2-nitro-1-(2-thienylmethyl)ethyl]malonate](/api/spectrum/9oj9D2xq2CY/structure.png?h=300&w=458 "Dimethyl [2-nitro-1-(2-thienylmethyl)ethyl]malonate")
