| SpectraBase Compound ID | IGy4pFrw0Mk |
|---|---|
| InChI | InChI=1S/C22H22N2/c1-19-7-11-21(12-8-19)23-15-3-5-17-24(18-6-4-16-23)22-13-9-20(2)10-14-22/h7-14H,15-18H2,1-2H3 |
| InChIKey | BIUMGDKCLFINPI-UHFFFAOYSA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C22H22N2 |
| Exact Mass | 314.178299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H4XgfS3P5AX |
|---|---|
| Name | N,N'-di(p-Tolyl)-1,6-diazacyclodeca-3,8-diyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.178298716 u |
| Formula | C22H22N2 |
| InChI | InChI=1S/C22H22N2/c1-19-7-11-21(12-8-19)23-15-3-5-17-24(18-6-4-16-23)22-13-9-20(2)10-14-22/h7-14H,15-18H2,1-2H3 |
| InChIKey | BIUMGDKCLFINPI-UHFFFAOYSA-N |
| SMILES | C=1(N2CC#CCN(CC#CC2)C2=CC=C(C=C2)C)C=CC(=CC1)C |