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2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4,6-dimethyl-3-pyridinecarbonitrile
SpectraBase Compound ID QUyH2KUA2J
InChI InChI=1S/C16H15N3O2/c1-10-7-11(2)18-16(13(10)9-17)19-12-3-4-14-15(8-12)21-6-5-20-14/h3-4,7-8H,5-6H2,1-2H3,(H,18,19)
InChIKey DCMQCOMQASORMW-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C16H15N3O2
Exact Mass 281.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21Ypz1XQ4LV
Name 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4,6-dimethyl-3-pyridinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O2
InChI InChI=1S/C16H15N3O2/c1-10-7-11(2)18-16(13(10)9-17)19-12-3-4-14-15(8-12)21-6-5-20-14/h3-4,7-8H,5-6H2,1-2H3,(H,18,19)
InChIKey DCMQCOMQASORMW-UHFFFAOYSA-N
Molecular Weight 281.315 g/mol
SMILES N(c1c(c(C)cc(n1)C)C#N)c1cc2OCCOc2cc1
SPLASH splash10-000t-3930000000-1fc1ac0d52e2366607a9
Synonyms 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4,6-dimethyl-pyridine-3-carbonitrile Nicotinonitrile, 2-(2,3-dihydrobenzo[1,4]dioxin-6-ylamino)-4,6-dimethyl- 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4,6-dimethylpyridine-3-carbonitrile
Wiley ID 1436574