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2-(1,2,2-trimethylcyclopentyl)propanenitrile
SpectraBase Compound ID 9IDBbV6ds1W
InChI InChI=1S/C11H19N/c1-9(8-12)11(4)7-5-6-10(11,2)3/h9H,5-7H2,1-4H3
InChIKey DWWNOWUGHSPGMN-UHFFFAOYSA-N
Mol Weight 165.28 g/mol
Molecular Formula C11H19N
Exact Mass 165.15175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Be56ld0xNi5
Name 2-(1,2,2-trimethylcyclopentyl)propanenitrile
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19N
InChI InChI=1S/C11H19N/c1-9(8-12)11(4)7-5-6-10(11,2)3/h9H,5-7H2,1-4H3
InChIKey DWWNOWUGHSPGMN-UHFFFAOYSA-N
Instrument Name MSD5975C
Ionization Type EI
Molecular Weight 165.280 g/mol
SMILES CC1(C)CCCC1(C(C)C#N)C
SPLASH splash10-0a4i-9300000000-7e10a4e3c4d6cfa7e3f9
Sample Comments Major isomer
Source of Spectrum WO2017097884A1
Wiley ID 1855403