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3-(3,4-Dimethoxyphenyl)propanenitrile
SpectraBase Compound ID 22l33KjPcHo
InChI InChI=1S/C11H13NO2/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h5-6,8H,3-4H2,1-2H3
InChIKey LECKQPWCSYMCDR-UHFFFAOYSA-N
Mol Weight 191.23 g/mol
Molecular Formula C11H13NO2
Exact Mass 191.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jmRy2nVA7x
Name 3-(3,4-dimethoxyphenyl)propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2
InChI InChI=1S/C11H13NO2/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h5-6,8H,3-4H2,1-2H3
InChIKey LECKQPWCSYMCDR-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202200868
Molecular Weight 191.230 g/mol
SMILES c1(cc(ccc1OC)CCC#N)OC
SPLASH splash10-0udi-2900000000-27c3b6715d911b471bb2
Source of Spectrum CSC-15-SM35-7a
Wiley ID 1876233