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23-methyl-2-pentacosanone
SpectraBase Compound ID 44iLpTuyaYA
InChI InChI=1S/C26H52O/c1-4-25(2)23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26(3)27/h25H,4-24H2,1-3H3
InChIKey PNUIVQWZHMXTOO-UHFFFAOYSA-N
Mol Weight 380.7 g/mol
Molecular Formula C26H52O
Exact Mass 380.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JV9BD5uwPaS
Name 23-methyl-2-pentacosanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H52O
InChI InChI=1S/C26H52O/c1-4-25(2)23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26(3)27/h25H,4-24H2,1-3H3
InChIKey PNUIVQWZHMXTOO-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 380.701 g/mol
SMILES CC(CCCCCCCCCCCCCCCCCCCCC(C)=O)CC
SPLASH splash10-0a4i-9000000000-69dccab4a475e082b84c
Source of Spectrum CBD-18-SM29-Figure S12-3
Wiley ID 1865222