![4-Sulfonic-calix[6]arene hydrate](/api/spectrum/Dsik3Iu0zVM/structure.png?h=300&w=458 "4-Sulfonic-calix[6]arene hydrate")
| SpectraBase Compound ID | FWpb6CfD0Sb |
|---|---|
| InChI | InChI=1S/C42H36O24S6.H2O/c43-37-19-1-20-8-32(68(52,53)54)10-22(38(20)44)3-24-12-34(70(58,59)60)14-26(40(24)46)5-28-16-36(72(64,65)66)18-30(42(28)48)6-29-17-35(71(61,62)63)15-27(41(29)47)4-25-13-33(69(55,56)57)11-23(39(25)45)2-21(37)9-31(7-19)67(49,50)51;/h7-18,43-48H,1-6H2,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);1H2 |
| InChIKey | SWWAZWAJPNREHZ-UHFFFAOYSA-N |
| Mol Weight | 1135.1 g/mol |
| Molecular Formula | C42H38O25S6 |
| Exact Mass | 1134.002644 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Dsik3Iu0zVM |
|---|---|
| Name | 4-Sulfonic-calix[6]arene hydrate |
| Source of Sample | Alfa Aesar, Thermo Fisher Scientific |
| Catalog Number | L13625 |
| Lot Number | 10136219 |
| CAS Registry Number | 102088-39-1 |
| Color Properties | Off-white |
| Copyright | Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H38O25S6 |
| InChI | InChI=1S/C42H36O24S6.H2O/c43-37-19-1-20-8-32(68(52,53)54)10-22(38(20)44)3-24-12-34(70(58,59)60)14-26(40(24)46)5-28-16-36(72(64,65)66)18-30(42(28)48)6-29-17-35(71(61,62)63)15-27(41(29)47)4-25-13-33(69(55,56)57)11-23(39(25)45)2-21(37)9-31(7-19)67(49,50)51;/h7-18,43-48H,1-6H2,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);1H2 |
| InChIKey | SWWAZWAJPNREHZ-UHFFFAOYSA-N |
| Instrument Name | Bruker Tensor 27 FT-IR |
| Molecular Weight | 1135.101 g/mol |
| Physical State | Solid |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Technique | KBr1 |