![N-([1,1'-Biphenyl]-4-ylethynyl)-4-methyl-N-(3-(phenylethynyl)cyclohex-2-en-1-yl)benzenesulfonamide](/api/spectrum/IHAxQxlSA6z/structure.png?h=300&w=458 "N-([1,1'-Biphenyl]-4-ylethynyl)-4-methyl-N-(3-(phenylethynyl)cyclohex-2-en-1-yl)benzenesulfonamide")
| SpectraBase Compound ID | 23o8fTKFxwh |
|---|---|
| InChI | InChI=1S/C35H29NO2S/c1-28-15-23-35(24-16-28)39(37,38)36(26-25-30-19-21-33(22-20-30)32-12-6-3-7-13-32)34-14-8-11-31(27-34)18-17-29-9-4-2-5-10-29/h2-7,9-10,12-13,15-16,19-24,27,34H,8,11,14H2,1H3 |
| InChIKey | QLBSOXZGLURHIN-UHFFFAOYSA-N |
| Mol Weight | 527.7 g/mol |
| Molecular Formula | C35H29NO2S |
| Exact Mass | 527.1919 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IHAxQxlSA6z |
|---|---|
| Name | N-([1,1'-Biphenyl]-4-ylethynyl)-4-methyl-N-(3-(phenylethynyl)cyclohex-2-en-1-yl)benzenesulfonamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H29NO2S |
| InChI | InChI=1S/C35H29NO2S/c1-28-15-23-35(24-16-28)39(37,38)36(26-25-30-19-21-33(22-20-30)32-12-6-3-7-13-32)34-14-8-11-31(27-34)18-17-29-9-4-2-5-10-29/h2-7,9-10,12-13,15-16,19-24,27,34H,8,11,14H2,1H3 |
| InChIKey | QLBSOXZGLURHIN-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/adsc.201801469 |
| Molecular Weight | 527.682 g/mol |
| SMILES | c1(ccc(cc1)C)S(N(C1C=C(CCC1)C#Cc1ccccc1)C#Cc1ccc(cc1)-c1ccccc1)(=O)=O |
| SPLASH | splash10-007o-1914000000-0017810dfd30a2b0a596 |
| Source of Spectrum | ASC-361-SM10-1d |
| Wiley ID | 1813968 |