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25-methyl-2-heptacosanone
SpectraBase Compound ID CjzTLlDiMt
InChI InChI=1S/C28H56O/c1-4-27(2)25-23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26-28(3)29/h27H,4-26H2,1-3H3
InChIKey HUYWOEQRTVEEFR-UHFFFAOYSA-N
Mol Weight 408.8 g/mol
Molecular Formula C28H56O
Exact Mass 408.433116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiPB4RPgubb
Name 25-methyl-2-heptacosanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H56O
InChI InChI=1S/C28H56O/c1-4-27(2)25-23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26-28(3)29/h27H,4-26H2,1-3H3
InChIKey HUYWOEQRTVEEFR-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 408.755 g/mol
SMILES CC(CCCCCCCCCCCCCCCCCCCCCCC(C)=O)CC
SPLASH splash10-0a4i-9000000000-3dfc9319af3a64e61e86
Source of Spectrum CBD-18-SM30-Figure S12-6
Wiley ID 1865225