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Pentacosane
SpectraBase Compound ID 4AQmIQ4G87U
InChI InChI=1S/C25H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3-25H2,1-2H3
InChIKey YKNWIILGEFFOPE-UHFFFAOYSA-N
Mol Weight 352.7 g/mol
Molecular Formula C25H52
Exact Mass 352.406902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xgQNwm5o5S
Name Pentacosane
CAS Registry Number 629-99-2
Classification Alkanes
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 352.406901674 u
Formula C25H52
InChI InChI=1S/C25H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3-25H2,1-2H3
InChIKey YKNWIILGEFFOPE-UHFFFAOYSA-N
Molecular Weight 352.691 g/mol
Number of Peaks 150
RI1 2500
RI4 2500
RI5 2172
SMILES CCCCCCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-0abl-9200000000-6bd979c9e196c24a491a
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Pentacosane
Wiley ID LM_LIPIDS2016_19