| SpectraBase Spectrum ID |
Dkhgj2fCPM5 |
| Name |
Benzoic acid, 2,2'-[2,4-bis(4-methoxyphenyl)-1,3-cyclobutanediyl]bis-, diethyl ester, (1.alpha.,2.beta.,3.alpha.,4.beta.)- |
| Alternate Name(s) |
Diethyl 2,2'-[t-2,t-4-di(p-methoxyphenyl)cyclobutane-t-1,c-3-diyl]dibenzoate
ethyl 2-[3-[2-(ethoxycarbonyl)phenyl]-2,4-bis(4-methoxyphenyl)cyclobutyl]benzoate |
| CAS Registry Number |
90340-80-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H36O6 |
| InChI |
InChI=1S/C36H36O6/c1-5-41-35(37)29-13-9-7-11-27(29)33-31(23-15-19-25(39-3)20-16-23)34(32(33)24-17-21-26(40-4)22-18-24)28-12-8-10-14-30(28)36(38)42-6-2/h7-22,31-34H,5-6H2,1-4H3/t31-,32+,33-,34+ |
| InChIKey |
WNLGRAIFUONNSN-WKKVWOBLSA-N |
| Molecular Weight |
564.678 g/mol |
| SMILES |
[C@]1([C@](c2ccc(cc2)OC)([C@]([C@@]1(c1ccc(cc1)OC)[H])(c1c(C(=O)OCC)cccc1)[H])[H])(c1c(C(=O)OCC)cccc1)[H] |
| SPLASH |
splash10-001i-0090000000-1107bdb47de8fb3379ec |
| Source of Spectrum |
B-37-575-0 |
| Wiley ID |
1407183 |
![Benzoic acid, 2,2'-[2,4-bis(4-methoxyphenyl)-1,3-cyclobutanediyl]bis-, diethyl ester, (1.alpha.,2.beta.,3.alpha.,4.beta.)-](/api/spectrum/Dkhgj2fCPM5/structure.png?h=300&w=458 "Benzoic acid, 2,2'-[2,4-bis(4-methoxyphenyl)-1,3-cyclobutanediyl]bis-, diethyl ester, (1.alpha.,2.beta.,3.alpha.,4.beta.)-")
