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3-[2-(Cyanomethyl)phenyl]propanal
SpectraBase Compound ID B4OTiyHhV0N
InChI InChI=1S/C11H11NO/c12-8-7-11-5-2-1-4-10(11)6-3-9-13/h1-2,4-5,9H,3,6-7H2
InChIKey HUUSWHJFKXYTTG-UHFFFAOYSA-N
Mol Weight 173.21 g/mol
Molecular Formula C11H11NO
Exact Mass 173.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7nkcTUrcym
Name 3-[2-(Cyanomethyl)phenyl]propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO
InChI InChI=1S/C11H11NO/c12-8-7-11-5-2-1-4-10(11)6-3-9-13/h1-2,4-5,9H,3,6-7H2
InChIKey HUUSWHJFKXYTTG-UHFFFAOYSA-N
Molecular Weight 173.215 g/mol
SMILES C(#N)Cc1c(CCC=O)cccc1
SPLASH splash10-0002-3900000000-37ac8071116ab59665ab
Source of Spectrum J-57-1441-40
Synonyms [2-(3-Oxopropyl)phenyl]acetonitrile 2-[2-(3-Oxopropyl)phenyl]acetonitrile 2-[2-(3-Oxidanylidenepropyl)phenyl]ethanenitrile
Wiley ID 1169908