![3,11,19,27-tetraoxa-33,34,35,36-tetraazapentacyclo[27.3.1.1~5,9~.1~13,17~.1~21,25~]hexatriaconta-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-dodecaene](/api/spectrum/8IcPm18DtHN/structure.png?h=300&w=458 "3,11,19,27-tetraoxa-33,34,35,36-tetraazapentacyclo[27.3.1.1~5,9~.1~13,17~.1~21,25~]hexatriaconta-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-dodecaene")
| SpectraBase Compound ID | Du8ZV75KMpV |
|---|---|
| InChI | InChI=1S/C28H28N4O4/c1-5-21-13-33-15-23-7-2-9-25(30-23)17-35-19-27-11-4-12-28(32-27)20-36-18-26-10-3-8-24(31-26)16-34-14-22(6-1)29-21/h1-12H,13-20H2 |
| InChIKey | IWENTTJQQMKWTM-UHFFFAOYSA-N |
| Mol Weight | 484.56 g/mol |
| Molecular Formula | C28H28N4O4 |
| Exact Mass | 484.211055 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 8IcPm18DtHN |
|---|---|
| Name | 3,11,19,27-tetraoxa-33,34,35,36-tetraazapentacyclo[27.3.1.1~5,9~.1~13,17~.1~21,25~]hexatriaconta-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-dodecaene |
| Author | A.V.Yarkov, IPAC, Russia |
| Copyright | Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C28H28N4O4/c1-5-21-13-33-15-23-7-2-9-25(30-23)17-35-19-27-11-4-12-28(32-27)20-36-18-26-10-3-8-24(31-26)16-34-14-22(6-1)29-21/h1-12H,13-20H2 |
| InChIKey | IWENTTJQQMKWTM-UHFFFAOYSA-N |
| NMR Offset | 15.3537 |
| NMR Spectrometer Frequency | 300.135 |
| Observed nucleus | 1H |
| Origin | 1H_UBI-VK_18310_17512 |
| Owner | Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State | soluted |
| Solvent | DMSO-d6 |
| Source File Reference | VendorID: 987/00005682; Labnumber: 987/00005682218869; VK_ID: VK-017517 |
| Temperature | 308 °C |