| SpectraBase Spectrum ID |
DdRLNv0vh3j |
| Name |
3-Oxepanone, 6,6-dimethyl-2-methylene-7-(3-oxobutylidene)- |
| CAS Registry Number |
102635-42-7 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O3 |
| InChI |
InChI=1S/C13H18O3/c1-9(14)5-6-12-13(3,4)8-7-11(15)10(2)16-12/h6H,2,5,7-8H2,1,3-4H3/b12-6- |
| InChIKey |
SJNYAUYQQIIRKA-SDQBBNPISA-N |
| Molecular Weight |
222.284 g/mol |
| SMILES |
C1(\C(OC(C(CC1)=O)=C)=C\CC(=O)C)(C)C |
| SPLASH |
splash10-0006-9200000000-66b9f53b8a3df0708825 |
| Source of Spectrum |
H-68-1101-21 |
| Synonyms |
(7Z)-6,6-dimethyl-2-methylene-7-(3-oxobutylidene)-3-oxepanone
4-(3'-Oxobutylidene)-5,5-dimethyl-2-methylidene-3-oxacycloheptanone |
| Wiley ID |
1222592 |
