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ATROPONITRILE
SpectraBase Compound ID 50ADmaWaNw7
InChI InChI=1S/C9H7N/c1-8(7-10)9-5-3-2-4-6-9/h2-6H,1H2
InChIKey RLFXJQPKMZNLMP-UHFFFAOYSA-N
Mol Weight 129.16 g/mol
Molecular Formula C9H7N
Exact Mass 129.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Um0piwYp7B
Name Benzeneacetonitrile, .alpha.-methylene-
CAS Registry Number 495-10-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N
InChI InChI=1S/C9H7N/c1-8(7-10)9-5-3-2-4-6-9/h2-6H,1H2
InChIKey RLFXJQPKMZNLMP-UHFFFAOYSA-N
Molecular Weight 129.162 g/mol
SMILES C=C(C#N)c1ccccc1
SPLASH splash10-004i-5900000000-4a2df12a2b5542992427
Source of Spectrum T-66-3016-0
Synonyms .alpha.-Cyanostyrene .alpha.-Phenylacrylonitrile 2-Phenyl-2-propenenitrile 2-Phenylacrylonitrile 2-Phenylprop-2-enenitrile Acrylonitrile, 2-phenyl- Atroponitrile
Wiley ID 1132240