| SpectraBase Spectrum ID |
4fu1w6R6UAW |
| Name |
2-Heptenenitrile, 6,6-dimethyl-4,5-dioxo-, (E)- |
| CAS Registry Number |
77987-18-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11NO2 |
| InChI |
InChI=1S/C9H11NO2/c1-9(2,3)8(12)7(11)5-4-6-10/h4-5H,1-3H3/b5-4+ |
| InChIKey |
DVKJFFGCSXMJJL-SNAWJCMRSA-N |
| Molecular Weight |
165.192 g/mol |
| SMILES |
C(C(\C=C\C#N)=O)(C(C)(C)C)=O |
| SPLASH |
splash10-0a4i-9000000000-5d94e90abb8500c302ef |
| Source of Spectrum |
B-36-974-0 |
| Synonyms |
(2E)-6,6-dimethyl-4,5-dioxo-2-heptenenitrile
Mixture of isomers (Z)- and (E)-6,6-dimethyl-4,5-dioxohept-2-enenitrile |
| Wiley ID |
1161330 |
