![4-tert-Butylcalix[4]arenetetraacetic acid tetraethyl ester](/api/spectrum/KvX56UbvQn2/structure.png?h=300&w=458 "4-tert-Butylcalix[4]arenetetraacetic acid tetraethyl ester")
| SpectraBase Compound ID | KF85Z4sSHgC |
|---|---|
| InChI | InChI=1S/C60H80O12/c1-17-65-49(61)33-69-53-37-21-39-27-46(58(8,9)10)29-41(54(39)70-34-50(62)66-18-2)23-43-31-48(60(14,15)16)32-44(56(43)72-36-52(64)68-20-4)24-42-30-47(59(11,12)13)28-40(55(42)71-35-51(63)67-19-3)22-38(53)26-45(25-37)57(5,6)7/h25-32H,17-24,33-36H2,1-16H3 |
| InChIKey | HZHADWCIBZZJNV-UHFFFAOYSA-N |
| Mol Weight | 993.3 g/mol |
| Molecular Formula | C60H80O12 |
| Exact Mass | 992.564978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KvX56UbvQn2 |
|---|---|
| Name | 4-tert-Butylcalix[4]arenetetraacetic acid tetraethyl ester |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 420484 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C60H80O12 |
| InChI | InChI=1S/C60H80O12/c1-17-65-49(61)33-69-53-37-21-39-27-46(58(8,9)10)29-41(54(39)70-34-50(62)66-18-2)23-43-31-48(60(14,15)16)32-44(56(43)72-36-52(64)68-20-4)24-42-30-47(59(11,12)13)28-40(55(42)71-35-51(63)67-19-3)22-38(53)26-45(25-37)57(5,6)7/h25-32H,17-24,33-36H2,1-16H3 |
| InChIKey | HZHADWCIBZZJNV-UHFFFAOYSA-N |
| Molecular Weight | 993.288 g/mol |
| Observed nucleus | 13C |
| Purity | 97% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_014282 |