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1,3-Cyclopentadienebutanenitrile, .alpha.-[2-(cyclopentadienyl)ethyl]-.alpha.-methyl-
SpectraBase Compound ID 2yCBXyIeLWQ
InChI InChI=1S/C17H21N/c1-17(14-18,12-10-15-6-2-3-7-15)13-11-16-8-4-5-9-16/h2-6,8H,7,9-13H2,1H3
InChIKey SEBZSXDZVLRHOO-UHFFFAOYSA-N
Mol Weight 239.36 g/mol
Molecular Formula C17H21N
Exact Mass 239.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Hr2kKylaPZ
Name 1,3-Cyclopentadienebutanenitrile, .alpha.-[2-(cyclopentadienyl)ethyl]-.alpha.-methyl-
CAS Registry Number 81400-71-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21N
InChI InChI=1S/C17H21N/c1-17(14-18,12-10-15-6-2-3-7-15)13-11-16-8-4-5-9-16/h2-6,8H,7,9-13H2,1H3
InChIKey SEBZSXDZVLRHOO-UHFFFAOYSA-N
Molecular Weight 239.362 g/mol
SMILES C(#N)C(CCC1=CC=CC1)(CCC1=CC=CC1)C
SPLASH splash10-0002-0910000000-1a3d2f5aacb1add6face
Source of Spectrum K-115-471-0
Synonyms 4-(1,3-cyclopentadien-1-yl)-2-[2-(1,3-cyclopentadien-1-yl)ethyl]-2-methylbutanenitrile 4-(1,3/2,5-cyclopentadien-1-yl)-2-[2-(1,3/2,5-cyclopentadien-1-yl)ethyl]-2-methylbutyronitrile
Wiley ID 1242203