| SpectraBase Spectrum ID |
2wcKf9ZfzEk |
| Name |
2-[(3R)-3,7-dimethyloct-6-enylidene]malonic acid dibenzyl ester |
| Alternate Name(s) |
2-[(3R)-3,7-dimethyloct-6-enylidene]propanedioic acid bis(phenylmethyl) ester
bis(phenylmethyl) 2-[(3R)-3,7-dimethyloct-6-enylidene]propanedioate
dibenzyl 2-[(3R)-3,7-dimethyloct-6-enylidene]propanedioate |
| CAS Registry Number |
120229-88-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H32O4 |
| InChI |
InChI=1S/C27H32O4/c1-21(2)11-10-12-22(3)17-18-25(26(28)30-19-23-13-6-4-7-14-23)27(29)31-20-24-15-8-5-9-16-24/h4-9,11,13-16,18,22H,10,12,17,19-20H2,1-3H3/t22-/m1/s1 |
| InChIKey |
DXTHAHLMDIOSIC-JOCHJYFZSA-N |
| Molecular Weight |
420.549 g/mol |
| SMILES |
C(=CC[C@@](CCC=C(C)C)(C)[H])(C(OCc1ccccc1)=O)C(OCc1ccccc1)=O |
| SPLASH |
splash10-004i-0009200000-a861e80586c3fe7054b7 |
| Source of Spectrum |
J-54-3126-9 |
| Wiley ID |
1378124 |
![2-[(3R)-3,7-dimethyloct-6-enylidene]malonic acid dibenzyl ester](/api/spectrum/2wcKf9ZfzEk/structure.png?h=300&w=458 "2-[(3R)-3,7-dimethyloct-6-enylidene]malonic acid dibenzyl ester")
