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4-(hexyloxy)phthalonitrile

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4-(hexyloxy)phthalonitrile
SpectraBase Compound ID H6Uc1L1Rafs
InChI InChI=1S/C14H16N2O/c1-2-3-4-5-8-17-14-7-6-12(10-15)13(9-14)11-16/h6-7,9H,2-5,8H2,1H3
InChIKey BMXSATBWGFIAPA-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C14H16N2O
Exact Mass 228.126263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KiUUQPhoy08
Name 4-(HEXYLOXY)PHTHALONITRILE1
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 4949-82-8
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O
InChI InChI=1S/C14H16N2O/c1-2-3-4-5-8-17-14-7-6-12(10-15)13(9-14)11-16/h6-7,9H,2-5,8H2,1H3
InChIKey BMXSATBWGFIAPA-UHFFFAOYSA-N
Molecular Weight 228.30
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PHTHALONITRILE, 4-/HEXYLOXY/-,