| SpectraBase Spectrum ID |
1zUnKUGknbj |
| Name |
(1.alpha.,2.alpha.,3.beta.,4.beta.)-1,3-dicyano-2,4-bis(2-methoxyphenyl)cyclobutane-1,3-dicarboxylic acid |
| CAS Registry Number |
109977-08-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H18N2O6 |
| InChI |
InChI=1S/C22H18N2O6/c1-29-15-9-5-3-7-13(15)17-21(11-23,19(25)26)18(22(17,12-24)20(27)28)14-8-4-6-10-16(14)30-2/h3-10,17-18H,1-2H3,(H,25,26)(H,27,28)/t17-,18-,21-,22+ |
| InChIKey |
QTWUZOKQOCGDPC-QRSOYHKCSA-N |
| Molecular Weight |
406.394 g/mol |
| SMILES |
OC([C@@]1([C@]([C@](C(=O)O)([C@@]1(c1c(OC)cccc1)[H])C#N)(c1c(OC)cccc1)[H])C#N)=O |
| SPLASH |
splash10-0a4i-0900000000-f81ec49cb68b7968356c |
| Source of Spectrum |
J-52-5126-3 |
| Synonyms |
1,3-Dicyano-2,4-bis(2-methoxyphenyl)-1,3-cyclobutanedicarboxylic acid |
| Wiley ID |
1372111 |
