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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 JHFgyrLjlzs
Name Pentacosane
CAS Registry Number 629-99-2
Classification Analytical reference standard
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. 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
Ionization Type Electron Ionization (EI)
Molecular Weight 352.691 g/mol
Nominal Mass 352 u
Quality 994
Retention Index 2500
SMILES C(CCCCCCCCCCCC)CCCCCCCCCCCC
SPLASH splash10-0abc-9100000000-54c21eddf4186a81ba78
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms pentacosane
Technique GC/MS
Wiley ID DD2024_033615