SpectraBase Compound ID | 7hUKmsmuB4W |
---|---|
InChI | InChI=1S/C13H9N/c14-10-12-8-5-4-7-11-6-2-1-3-9-13(11)12/h1-9H |
InChIKey | FPFOLYNSRIQVDT-UHFFFAOYSA-N |
Mol Weight | 179.22 g/mol |
Molecular Formula | C13H9N |
Exact Mass | 179.073499 g/mol |
SpectraBase Spectrum ID | 9tgtxQO8Qcn |
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Name | 1-Heptalenecarbonitrile |
CAS Registry Number | 87306-22-7 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H9N |
InChI | InChI=1S/C13H9N/c14-10-12-8-5-4-7-11-6-2-1-3-9-13(11)12/h1-9H |
InChIKey | FPFOLYNSRIQVDT-UHFFFAOYSA-N |
Molecular Weight | 179.222 g/mol |
SMILES | C12=C(C#N)C=CC=CC2=CC=CC=C1 |
SPLASH | splash10-0ufr-0900000000-304af9c949c101688713 |
Source of Spectrum | F-42-1754-5 |
Synonyms | 1-Cyanoheptalene |
Wiley ID | 1175501 |