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3-(2,3,4-Trimethoxyphenyl)propanenitrile
SpectraBase Compound ID 6AdUyfL9NQN
InChI InChI=1S/C12H15NO3/c1-14-10-7-6-9(5-4-8-13)11(15-2)12(10)16-3/h6-7H,4-5H2,1-3H3
InChIKey IKYZOGGMJXYANI-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EA50Hx3XQDx
Name 3-(2,3,4-trimethoxyphenyl)propanenitrile
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-14-10-7-6-9(5-4-8-13)11(15-2)12(10)16-3/h6-7H,4-5H2,1-3H3
InChIKey IKYZOGGMJXYANI-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801412
Molecular Weight 221.256 g/mol
SMILES COc1c(c(c(cc1)CCC#N)OC)OC
SPLASH splash10-001i-0910000000-27b82e4d5576cc02268a
Source of Spectrum U1-2019-SM16-1p
Wiley ID 1843573