| SpectraBase Spectrum ID |
2PE604CWMPv |
| Name |
4-[2-(4-Nitrophenyl)ethynyl]phthalonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H7N3O2 |
| InChI |
InChI=1S/C16H7N3O2/c17-10-14-6-3-13(9-15(14)11-18)2-1-12-4-7-16(8-5-12)19(20)21/h3-9H |
| InChIKey |
PCMASEMZYVMMQV-UHFFFAOYSA-N |
| Molecular Weight |
273.251 g/mol |
| SMILES |
C(c1c(C#N)cc(cc1)C#Cc1ccc(cc1)N(=O)=O)#N |
| SPLASH |
splash10-00di-0090000000-af2253fb411af1ef5fee |
| Source of Spectrum |
J-65-2737-5 |
| Synonyms |
4-[2-(4-nitrophenyl)ethynyl]benzene-1,2-dicarbonitrile |
| Wiley ID |
1532549 |
![4-[2-(4-Nitrophenyl)ethynyl]phthalonitrile](/api/spectrum/2PE604CWMPv/structure.png?h=300&w=458 "4-[2-(4-Nitrophenyl)ethynyl]phthalonitrile")
