| SpectraBase Spectrum ID |
3ZMhKg0OqiU |
| Name |
Methyl-.alpha.-cyano-.beta.-methoxy-p-nitrocinnamate |
| Alternate Name(s) |
methyl (2Z)-2-cyano-3-methoxy-3-(4-nitrophenyl)-2-propenoate |
| CAS Registry Number |
80641-27-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H10N2O5 |
| InChI |
InChI=1S/C12H10N2O5/c1-18-11(10(7-13)12(15)19-2)8-3-5-9(6-4-8)14(16)17/h3-6H,1-2H3/b11-10- |
| InChIKey |
XBEXBRMWHLBBDS-KHPPLWFESA-N |
| Molecular Weight |
262.221 g/mol |
| SMILES |
c1(\C(=C\(C(=O)OC)C#N)OC)ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-01q9-0090000000-e1387f02f01af8bbc35a |
| Source of Spectrum |
J-47-1407-0 |
| Wiley ID |
1265422 |
