SpectraBase Spectrum ID |
80gI811LgUU |
Name |
ACETIC ACID, 5-(2,2-DIMETHYL-6-OXO-CYCLOHEXYLIDENE)-3-METHYL-PENT-3-ENYL ESTER |
Copyright |
Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C16H24O3 |
InChI |
InChI=1S/C16H24O3/c1-12(9-11-19-13(2)17)7-8-14-15(18)6-5-10-16(14,3)4/h7-8H,5-6,9-11H2,1-4H3/b12-7+,14-8+ |
InChIKey |
XTKCOWLMUGKWBS-BKKXBQFWSA-N |
Molecular Weight |
264.1719 |
SMILES |
C1CC(=O)\C(=C/C=C/(CCOC(C)=O)C)C(C)(C)C1 |
SPLASH |
splash10-004i-5900000000-c2cde15fa23829f17909 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |