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NVAOLENBKNECGF-UHFFFAOYSA-N
SpectraBase Compound ID DvktfPEK9Pz
InChI InChI=1S/C9H9N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,1H3
InChIKey NVAOLENBKNECGF-UHFFFAOYSA-N
Mol Weight 131.18 g/mol
Molecular Formula C9H9N
Exact Mass 131.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4qnv3nQRJE
Name Benzeneacetonitrile, .alpha.-methyl-
CAS Registry Number 1823-91-2
Comments Less than 3 mono-isotopic peaks
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Formula C9H9N
InChI InChI=1S/C9H9N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,1H3
InChIKey NVAOLENBKNECGF-UHFFFAOYSA-N
Molecular Weight 131.178 g/mol
SMILES C(#N)C(C)c1ccccc1
SPLASH splash10-0a4i-0900000000-dd793a8107311c0e9a57
Source of Spectrum F-52-8617-2
Synonyms .alpha.-Cyanoethylbenzene .alpha.-Methylbenzeneacetonitrile .alpha.-Methylbenzyl cyanide .alpha.-Methylphenylacetonitrile .alpha.-Phenylethyl cyanide .alpha.-Phenylpropionitrile 2-Phenylpropanenitrile 2-Phenylpropionitrile 2-Phenylpropiononitrile Hydratroponitrile AI3-07025 EINECS 217-354-9 NSC 11264 NSC 37485
Wiley ID 797197