| SpectraBase Spectrum ID |
LNmrUTx8DAe |
| Name |
Dimethyl 2,2'-dichloro-6,6'-dimethoxy-.beta.-truxinate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22Cl2O6 |
| InChI |
InChI=1S/C22H22Cl2O6/c1-27-13-9-5-7-11(23)15(13)17-18(16-12(24)8-6-10-14(16)28-2)20(22(26)30-4)19(17)21(25)29-3/h5-10,17-20H,1-4H3 |
| InChIKey |
NMFJXBPTIAYHPB-UHFFFAOYSA-N |
| Molecular Weight |
453.318 g/mol |
| SMILES |
C1(C(c2c(Cl)cccc2OC)C(C1C(=O)OC)C(=O)OC)c1c(Cl)cccc1OC |
| SPLASH |
splash10-004i-0090400000-3f2b4cfbfc678e5c43df |
| Source of Spectrum |
KC-0-860-2 |
| Wiley ID |
821368 |
