| SpectraBase Spectrum ID |
1HpGSvPvDMs |
| Name |
Ethyl (E)-4-Oxopent-2-enedioate |
| Alternate Name(s) |
diethyl (2E)-4-oxo-2-pentenedioate
(E)-4-oxo-2-pentenedioic acid diethyl ester
diethyl (E)-4-oxopent-2-enedioate
diethyl (E)-4-oxidanylidenepent-2-enedioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12O5 |
| InChI |
InChI=1S/C9H12O5/c1-3-13-8(11)6-5-7(10)9(12)14-4-2/h5-6H,3-4H2,1-2H3/b6-5+ |
| InChIKey |
PPGJXXBYSGZKDK-AATRIKPKSA-N |
| Molecular Weight |
200.190 g/mol |
| SMILES |
C(C(\C=C\C(=O)OCC)=O)(=O)OCC |
| SPLASH |
splash10-004i-0910000000-a5a8d5f27a2b79078f0e |
| Source of Spectrum |
K1-0-2846-2 |
| Wiley ID |
1589025 |
