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3,6-Dioctyloxy-1,2-benzenedicarbonitrile

View entire compound with spectra: 2 NMR, and 1 FTIR

3,6-Dioctyloxy-1,2-benzenedicarbonitrile
SpectraBase Compound ID HUYUWLfBsN2
InChI InChI=1S/C24H36N2O2/c1-3-5-7-9-11-13-17-27-23-15-16-24(22(20-26)21(23)19-25)28-18-14-12-10-8-6-4-2/h15-16H,3-14,17-18H2,1-2H3
InChIKey GKGPSCRTAALNMD-UHFFFAOYSA-N
Mol Weight 384.6 g/mol
Molecular Formula C24H36N2O2
Exact Mass 384.277678 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EQqMgle6etB
Name 3,6-Dioctyloxy-1,2-benzenedicarbonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 429481
CAS Registry Number 75942-39-1
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36N2O2
InChI 1S/C24H36N2O2/c1-3-5-7-9-11-13-17-27-23-15-16-24(22(20-26)21(23)19-25)28-18-14-12-10-8-6-4-2/h15-16H,3-14,17-18H2,1-2H3
InChIKey GKGPSCRTAALNMD-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3,6-Dioctyloxyphthalonitrile 1,2-Benzenedicarbonitrile,3,6-bis(octyloxy)-
Wiley ID SIAL_13CNMR_009499