SpectraBase Spectrum ID |
6xDaPyXl1S2 |
Name |
2-Propenoic acid, 2-cyano-3-[5-(hydroxymethyl)-1H-pyrrol-2-yl]-, ethyl ester |
CAS Registry Number |
70582-65-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H12N2O3 |
InChI |
InChI=1S/C11H12N2O3/c1-2-16-11(15)8(6-12)5-9-3-4-10(7-14)13-9/h3-5,13-14H,2,7H2,1H3/b8-5+ |
InChIKey |
KPTMKCMVOOVVGZ-VMPITWQZSA-N |
Molecular Weight |
220.228 g/mol |
SMILES |
[nH]1c(CO)ccc1\C=C\(C(=O)OCC)C#N |
SPLASH |
splash10-00dj-0920000000-1c74d3901f1b6789c93f |
Source of Spectrum |
SB-33-130-0 |
Synonyms |
2-(ethoxycarbonylcyanomethyl)-5-hydroxymethylpyrrole
2-Cyanoacrylate-5-pyrrolemethanol
Ethyl (2E)-2-cyano-3-[5-(hydroxymethyl)-1H-pyrrol-2-yl]-2-propenoate |
Wiley ID |
1219546 |