| SpectraBase Spectrum ID |
KAeBdHS2suK |
| Name |
5,11,17,23-Tetra-tert-butyl-25-hydroxy-26,27,28-tris(hydrazinocarbonylmethyloxy)calix[4]arene |
| Comments |
Note: The molecular formula of the structure shown is C51H70N6O7 - which differs from the formula reported for the mass spectrum (C53H68O10) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C53H68O10 |
| InChI |
InChI=1S/C51H70N6O7/c1-48(2,3)37-18-29-13-14-30-19-38(49(4,5)6)22-33(45(30)62-26-41(58)55-52)16-34-23-40(51(10,11)12)25-36(47(34)64-28-43(60)57-54)17-35-24-39(50(7,8)9)21-32(15-31(20-37)44(29)61)46(35)63-27-42(59)56-53/h18-25,61H,13-17,26-28,52-54H2,1-12H3,(H,55,58)(H,56,59)(H,57,60) |
| InChIKey |
MYUMQRPYSYUFJP-UHFFFAOYSA-N |
| Molecular Weight |
879.156 g/mol |
| SMILES |
N(C(COc1c2CCc3c(c(Cc4c(c(Cc5c(c(Cc1cc(c2)C(C)(C)C)cc(c5)C(C)(C)C)OCC(=O)NN)cc(c4)C(C)(C)C)OCC(=O)NN)cc(c3)C(C)(C)C)O)=O)N |
| SPLASH |
splash10-0292-0000000090-71c3c6928f3324606130 |
| Source of Spectrum |
O1-36-1324-4 |
| Wiley ID |
819922 |
![5,11,17,23-Tetra-tert-butyl-25-hydroxy-26,27,28-tris(hydrazinocarbonylmethyloxy)calix[4]arene](/api/spectrum/KAeBdHS2suK/structure.png?h=300&w=458 "5,11,17,23-Tetra-tert-butyl-25-hydroxy-26,27,28-tris(hydrazinocarbonylmethyloxy)calix[4]arene")
