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3,6-Bis(heptyloxy)phthalonitrile

View entire compound with spectra: 1 MS (GC)

3,6-Bis(heptyloxy)phthalonitrile
SpectraBase Compound ID 5E41SjBuCOr
InChI InChI=1S/C22H32N2O2/c1-3-5-7-9-11-15-25-21-13-14-22(20(18-24)19(21)17-23)26-16-12-10-8-6-4-2/h13-14H,3-12,15-16H2,1-2H3
InChIKey MWWWSCBMIMDNLU-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C22H32N2O2
Exact Mass 356.246378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fqm5oTcimiy
Name 3,6-Bis(heptyloxy)phthalonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32N2O2
InChI InChI=1S/C22H32N2O2/c1-3-5-7-9-11-15-25-21-13-14-22(20(18-24)19(21)17-23)26-16-12-10-8-6-4-2/h13-14H,3-12,15-16H2,1-2H3
InChIKey MWWWSCBMIMDNLU-UHFFFAOYSA-N
Molecular Weight 356.510 g/mol
SMILES C(c1c(C#N)c(ccc1OCCCCCCC)OCCCCCCC)#N
SPLASH splash10-0bta-9400000000-415f90e675a8575cf796
Source of Spectrum CV-2005-1145-2
Synonyms 3,6-Diheptoxybenzene-1,2-dicarbonitrile
Wiley ID 1611676