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4-Cyano-4-(3',5'-dimethyl-4'-oxazolyl)-pimelonitrile
SpectraBase Compound ID 2bLYVFTkcKl
InChI InChI=1S/C13H14N4O/c1-10-12(11(2)18-17-10)13(9-16,5-3-7-14)6-4-8-15/h3-6H2,1-2H3
InChIKey BXJZCRYFWADPKI-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C13H14N4O
Exact Mass 242.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhvV5FsTUh3
Name 4-Cyano-4-(3',5'-dimethyl-4'-oxazolyl)-pimelonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N4O
InChI InChI=1S/C13H14N4O/c1-10-12(11(2)18-17-10)13(9-16,5-3-7-14)6-4-8-15/h3-6H2,1-2H3
InChIKey BXJZCRYFWADPKI-UHFFFAOYSA-N
Molecular Weight 242.282 g/mol
SMILES c1(c(onc1C)C)C(C#N)(CCC#N)CCC#N
SPLASH splash10-0f77-4920000000-46553577fe6fd2375a34
Source of Spectrum Y4-83-192-46
Synonyms 3-(3,5-dimethyl-4-isoxazolyl)-1,3,5-pentanetricarbonitrile 3-(3,5-dimethyl-4-isoxazolyl)pentane-1,3,5-tricarbonitrile 3-(3,5-dimethyl-1,2-oxazol-4-yl)pentane-1,3,5-tricarbonitrile
Wiley ID 1550015