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3-[2-(1,3-Dioxan-2-yl)ethyl]-1-benzofuran-2-carbonitrile
SpectraBase Compound ID Jyaat3KMyWM
InChI InChI=1S/C15H15NO3/c16-10-14-12(6-7-15-17-8-3-9-18-15)11-4-1-2-5-13(11)19-14/h1-2,4-5,15H,3,6-9H2
InChIKey DAKWBFGEADGXER-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C15H15NO3
Exact Mass 257.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbLNPeLEzyC
Name 3-[2-(1,3-Dioxan-2-yl)ethyl]-1-benzofuran-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO3
InChI InChI=1S/C15H15NO3/c16-10-14-12(6-7-15-17-8-3-9-18-15)11-4-1-2-5-13(11)19-14/h1-2,4-5,15H,3,6-9H2
InChIKey DAKWBFGEADGXER-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol401610e
Molecular Weight 257.289 g/mol
SMILES c1cc2c(CCC3OCCCO3)c(C#N)oc2cc1
SPLASH splash10-000i-9600000000-b4c779f7f60efa00b08e
Source of Spectrum A1-15-3876/SMS16-17d
Synonyms 3-(2-(1,3-dioxan-2-yl)ethyl)benzofuran-2-carbonitrile
Wiley ID 1748946