| SpectraBase Spectrum ID |
7dpcmonuFpR |
| Name |
2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-1-(3-oxobutyl)- |
| CAS Registry Number |
108161-85-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O5 |
| InChI |
InChI=1S/C13H18O5/c1-9(14)4-5-13(12(15)16)7-10(17-2)6-11(8-13)18-3/h7-8H,4-6H2,1-3H3,(H,15,16) |
| InChIKey |
VAFRUQVZZBAKKR-UHFFFAOYSA-N |
| Molecular Weight |
254.282 g/mol |
| SMILES |
OC(C1(C=C(OC)CC(=C1)OC)CCC(=O)C)=O |
| SPLASH |
splash10-0udi-0910000000-e293d28c5c77bffafb9d |
| Source of Spectrum |
F-42-2890-39 |
| Synonyms |
1,3-Dimethoxy-5-hydroxycarbonyl-5-(3-oxo-butyl)-cyclohexa-3,6-diene
3,5-Dimethoxy-1-(3-oxobutyl)-2,5-cyclohexadiene-1-carboxylic acid |
| Wiley ID |
1257505 |
