| SpectraBase Spectrum ID |
3aYY4HeA3PT |
| Name |
2-(Methoxycarbonyl)-.alpha.-nitrocinnamyl-nitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H8N2O4 |
| InChI |
InChI=1S/C11H8N2O4/c1-17-11(14)10-5-3-2-4-8(10)6-9(7-12)13(15)16/h2-6H,1H3/b9-6+ |
| InChIKey |
ANUDPMFIVFACOC-RMKNXTFCSA-N |
| Molecular Weight |
232.195 g/mol |
| SMILES |
c1(\C=C/(N(=O)=O)C#N)c(C(=O)OC)cccc1 |
| SPLASH |
splash10-000i-0900000000-c80eda10c408b78dd46a |
| Source of Spectrum |
D8-326-860-6 |
| Synonyms |
methyl 2-[(E)-2-cyano-2-nitroethenyl]benzoate |
| Wiley ID |
1514909 |
