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3-Azanylidene-1,7-dimethyl-5-pyridin-4-yl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
SpectraBase Compound ID 5JAdeiIknqh
InChI InChI=1S/C16H13N5O2/c1-10-14(2)22-12(11-3-5-21-6-4-11)16(9-19,13(20)23-14)15(10,7-17)8-18/h3-6,10,12,20H,1-2H3
InChIKey JZFFCGJCFRUNOP-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C16H13N5O2
Exact Mass 307.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4PplJlurfk
Name 3-Azanylidene-1,7-dimethyl-5-pyridin-4-yl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N5O2
InChI InChI=1S/C16H13N5O2/c1-10-14(2)22-12(11-3-5-21-6-4-11)16(9-19,13(20)23-14)15(10,7-17)8-18/h3-6,10,12,20H,1-2H3
InChIKey JZFFCGJCFRUNOP-UHFFFAOYSA-N
Molecular Weight 307.313 g/mol
SMILES N=C1C2(C(C(C)C(OC2c2ccncc2)(C)O1)(C#N)C#N)C#N
SPLASH splash10-052f-9500000000-8db24f73cb090367a7c6
Synonyms 3-imino-1,7-dimethyl-5-(4-pyridyl)-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile 3-imino-1,7-dimethyl-5-pyridin-4-yl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Wiley ID 1511409