| SpectraBase Spectrum ID |
9zmlRK7njN7 |
| Name |
meso-2,3-Bis(3,4-dimethoxybenzyl)butanedioic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O8 |
| InChI |
InChI=1S/C22H26O8/c1-27-17-7-5-13(11-19(17)29-3)9-15(21(23)24)16(22(25)26)10-14-6-8-18(28-2)20(12-14)30-4/h5-8,11-12,15-16H,9-10H2,1-4H3,(H,23,24)(H,25,26)/t15-,16+ |
| InChIKey |
NCLKBTXJCZVFDN-IYBDPMFKSA-N |
| Molecular Weight |
418.442 g/mol |
| SMILES |
OC([C@]([C@](C(=O)O)(Cc1cc(OC)c(cc1)OC)[H])(Cc1cc(OC)c(cc1)OC)[H])=O |
| SPLASH |
splash10-0udi-0900500000-d455f907055eeadf5653 |
| Source of Spectrum |
F-52-12810-12 |
| Synonyms |
(2R,3S)-2,3-bis(3,4-dimethoxybenzyl)butanedioic acid
(2S,3R)-2,3-bis[(3,4-dimethoxyphenyl)methyl]butanedioic acid |
| Wiley ID |
799032 |
