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Benzeneacetonitrile
SpectraBase Compound ID IIvwXzLRDGz
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2
InChIKey SUSQOBVLVYHIEX-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C8H7N
Exact Mass 117.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6L1rhZuP1AA
Name 1-Phenyl-2-ethylnitrile
CAS Registry Number 140-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2
InChIKey SUSQOBVLVYHIEX-UHFFFAOYSA-N
Molecular Weight 117.151 g/mol
SMILES C(#N)Cc1ccccc1
SPLASH splash10-014i-9300000000-ff020c39e45dc77c688b
Source of Spectrum AA-0-441-2
Synonyms Benzyl cyanide Benzylnitrile Benzeneacetonitrile Phenylacetonitrile (Cyanomethyl)benzene .alpha.-Cyanotoluene alpha-Tolunitrile .alpha.-Tolunitrile 2-Phenylacetonitrile alpha-Cyanotoluene 2-Phenylethanenitrile Acetic acid, phenyl-nitrile Acetonitrile, phenyl- Benzyl nitrile Benzyl-cyanide Benzylkyanid Omega-cyanotoluene Phenacetonitrile Phenyl acetyl nitrile Toluene, .alpha.-cyano- USAF KF-21 AI3-04975 CCRIS 4698 EINECS 205-410-5 HSDB 2103 NSC 118418 PHENYLACETONITRILE, LIQUID UN2470
Wiley ID 1126146