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Dodecanenitrile
SpectraBase Compound ID 3cHpZbJv8RU
InChI InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3
InChIKey VXCUURYYWGCLIH-UHFFFAOYSA-N
Mol Weight 181.32 g/mol
Molecular Formula C12H23N
Exact Mass 181.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RxUUCQUgi
Name Lauronitrile
Appearance Clear, colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 181.183049745 u
Formula C12H23N
InChI InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3
InChIKey VXCUURYYWGCLIH-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600549
Molecular Weight 181.323 g/mol
SMILES C(CCCCCCCCCCC)#N
SPLASH splash10-06ry-9300000000-ed15e641dd6179e7bf26
Source of Spectrum QE-22-SM10-Table 2, entry 15 (DOI: 10.1002/chem.201600549)
Wiley ID 1903091