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(E)-12-methyltridec-3-enenitrile

View entire compound with spectra: 1 MS (GC)

(E)-12-methyltridec-3-enenitrile
SpectraBase Compound ID BWgt7Aq3mc7
InChI InChI=1S/C14H25N/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15/h7,9,14H,3-6,8,10-12H2,1-2H3/b9-7+
InChIKey RKWOPJGPDIRMKB-VQHVLOKHSA-N
Mol Weight 207.36 g/mol
Molecular Formula C14H25N
Exact Mass 207.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fRWkUZKuQK
Name (E)-12-methyltridec-3-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25N
InChI InChI=1S/C14H25N/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15/h7,9,14H,3-6,8,10-12H2,1-2H3/b9-7+
InChIKey RKWOPJGPDIRMKB-VQHVLOKHSA-N
Instrument Name HP 5973-6890
Ionization Type EI
Literature Reference DOI 10.1002/anie.201611940
Molecular Weight 207.361 g/mol
Quality 552
SMILES CC(CCCCCCC\C=C\CC#N)C
SPLASH splash10-0aou-9300000000-c0c04f9110948dff8b68
Source of Spectrum ACI-56-SM28-10 (DOI: 10.1002/anie.201611940)
Wiley ID 1895608