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1-Cyano-heptalene
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tgtxQO8Qcn
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