For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Bicyclo[4.2.0]octa-1,3,5-triene-8-carbonitrile

View entire compound with spectra: 3 NMR, 3 FTIR, 1 Raman, and 1 MS (GC)

Bicyclo[4.2.0]octa-1,3,5-triene-8-carbonitrile
SpectraBase Compound ID JBhXEtXgHIj
InChI InChI=1S/C9H7N/c10-6-8-5-7-3-1-2-4-9(7)8/h1-4,8H,5H2
InChIKey FJIDKRPZJBUHME-UHFFFAOYSA-N
Mol Weight 129.16 g/mol
Molecular Formula C9H7N
Exact Mass 129.057849 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GbmOQ8ajbz
Name 1-Benzocyclobutenecarbonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 324892
CAS Registry Number 6809-91-2
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N
InChI 1S/C9H7N/c10-6-8-5-7-3-1-2-4-9(7)8/h1-4,8H,5H2
InChIKey FJIDKRPZJBUHME-UHFFFAOYSA-N
Observed nucleus 13C
Purity >=95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_006458