SpectraBase Spectrum ID |
DpLfmAuVeJ9 |
Name |
3,7-Cyclodecadiene-1-acetic acid, 5-(benzoyloxy)-4,8-dimethyl-2,10-dioxo-, ethyl ester, [1R-(1R*,3Z,5R*,7E)]- |
CAS Registry Number |
121115-16-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H26O6 |
InChI |
InChI=1S/C23H26O6/c1-4-28-22(26)14-18-19(24)12-15(2)10-11-21(16(3)13-20(18)25)29-23(27)17-8-6-5-7-9-17/h5-10,13,18,21H,4,11-12,14H2,1-3H3/b15-10-,16-13-/t18-,21-/m1/s1 |
InChIKey |
AAYNDMYRNBKRAG-WIKBLITNSA-N |
Molecular Weight |
398.455 g/mol |
SMILES |
[C@]1(C(\C=C/([C@](OC(=O)c2ccccc2)(C\C=C/(CC1=O)C)[H])C)=O)(CC(=O)OCC)[H] |
SPLASH |
splash10-0a4i-0920000000-aee2c65198932aa89d51 |
Source of Spectrum |
AJ-61-1210-17 |
Synonyms |
(1R,5R)-5-(2-ethoxy-2-oxoethyl)-2,8-dimethyl-4,6-dioxo-2,8-cyclodecadien-1-yl benzoate
Ethyl (3R,7R,1(10)e,4Z)-3-benzoyloxy-6,8-dioxo-13-nor-1(10),4-germacradien-12-oate |
Wiley ID |
1368466 |