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2(or 3)-Tridecenenitrile isomer III
SpectraBase Compound ID BhTulnnZalf
InChI InChI=1S/C13H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-12H,2-10H2,1H3/b12-11+
InChIKey WKSPQBFDRTUGEF-VAWYXSNFSA-N
Mol Weight 193.33 g/mol
Molecular Formula C13H23N
Exact Mass 193.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tcz3JYFsPp
Name 2(or 3)-Tridecenenitrile isomer II
CAS Registry Number 22629-49-8
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 193.183049745 u
Formula C13H23N
InChI InChI=1S/C13H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-12H,2-10H2,1H3/b12-11+
InChIKey WKSPQBFDRTUGEF-VAWYXSNFSA-N
Molecular Weight 193.334 g/mol
Number of Peaks 50
RI1 1576
RI2 1254
RI3 1630
RI4 1588
RI5 1546
SMILES C(\C=C\CCCCCCCCCC)#N
SPLASH splash10-052f-9200000000-b87f4f91597b3c3fb187
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2(or 3)-Tridecenenitrile
Wiley ID LM_FFNSC3_3300