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2-[3-(cyanomethyl)phenyl]acetonitrile
SpectraBase Compound ID AIGBMfELLsF
InChI InChI=1S/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H2
InChIKey GRPFZJNUYXIVSL-UHFFFAOYSA-N
Mol Weight 156.19 g/mol
Molecular Formula C10H8N2
Exact Mass 156.068748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LIXinPUmWa
Name 1,3-Benzenediacetonitrile
Alternate Name(s) m-Benzenediacetonitrile 1,3-Bis(cyanomethyl)benzene 1,3-Phenylenediacetonitrile 2-[3-(Cyanomethyl)phenyl]acetonitrile 2-[3-(Cyanomethyl)phenyl]ethanenitrile Acetonitrile, m-phenylenedi- m-Bis(cyanomethyl)benzene m-Phenylenediacetonitrile m-Xylylene dicyanide BRN 3240670 EINECS 210-936-3 NSC 77095
CAS Registry Number 626-22-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2
InChI InChI=1S/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H2
InChIKey GRPFZJNUYXIVSL-UHFFFAOYSA-N
Molecular Weight 156.188 g/mol
SMILES c1c(cccc1CC#N)CC#N
SPLASH splash10-014i-3900000000-23fb8736906ed8d1d8ec
Source of Spectrum AD-0-2532-0
Wiley ID 1422891