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4-(2-furoyl)-4-methylheptanedinitrile

View entire compound with spectra: 4 NMR, 1 FTIR, and 1 MS (GC)

4-(2-furoyl)-4-methylheptanedinitrile
SpectraBase Compound ID EAlYwUjoaNi
InChI InChI=1S/C13H14N2O2/c1-13(6-3-8-14,7-4-9-15)12(16)11-5-2-10-17-11/h2,5,10H,3-4,6-7H2,1H3
InChIKey HCAQRMDJEKFXGO-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BmCl5AAaZox
Name 4-(2-furoyl)-4-methylheptanedinitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H14N2O2/c1-13(6-3-8-14,7-4-9-15)12(16)11-5-2-10-17-11/h2,5,10H,3-4,6-7H2,1H3
InChIKey HCAQRMDJEKFXGO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17722
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 987/00006035; Labnumber: 987/00006035218874; VK_ID: VK-017727
Temperature 318 °C