| SpectraBase Spectrum ID |
AMfyJJr3SdZ |
| Name |
1-cyano-3-hydroxy-4-methyl-1-(2,4-pentadienyl)-3-cyclopentene-2,5-dione |
| Alternate Name(s) |
3-Hydroxy-4-methyl-2,5-dioxo-1-[(2E)-2,4-pentadienyl]-3-cyclopentene-1-carbonitrile |
| CAS Registry Number |
109035-30-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H11NO3 |
| InChI |
InChI=1S/C12H11NO3/c1-3-4-5-6-12(7-13)10(15)8(2)9(14)11(12)16/h3-5,14H,1,6H2,2H3/b5-4+ |
| InChIKey |
QVSFJXOCLJMZAW-SNAWJCMRSA-N |
| Molecular Weight |
217.224 g/mol |
| SMILES |
OC=1C(C(C(C1C)=O)(C#N)C\C=C\C=C)=O |
| SPLASH |
splash10-014i-9130000000-c4b85f6bf0b6437b7757 |
| Source of Spectrum |
J-52-3966-64 |
| Wiley ID |
1216542 |
