| SpectraBase Spectrum ID |
1WBvX0Z7Om5 |
| Name |
Methyl 4-isocyanato-3-(phenylethynyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H11NO3 |
| InChI |
InChI=1S/C17H11NO3/c1-21-17(20)15-9-10-16(18-12-19)14(11-15)8-7-13-5-3-2-4-6-13/h2-6,9-11H,1H3 |
| InChIKey |
AYOJUIRPLQQEAW-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol9014877 |
| Molecular Weight |
277.279 g/mol |
| SMILES |
c1(cc(C#Cc2ccccc2)c(cc1)N=C=O)C(=O)OC |
| SPLASH |
splash10-004j-0290000000-24649920f4f4b6ed8cfe |
| Source of Spectrum |
A1-11-4262/SMS11-1d |
| Synonyms |
Methyl 4-isocyanato-3-(2-phenylethynyl)benzoate |
| Wiley ID |
1757152 |
