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2-Heptacosanone

View entire compound with spectra: 1 NMR, and 2 MS (GC)

2-Heptacosanone
SpectraBase Compound ID C2p4nJN95XJ
InChI InChI=1S/C27H54O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(2)28/h3-26H2,1-2H3
InChIKey MJEFMWGOVVCQIK-UHFFFAOYSA-N
Mol Weight 394.7 g/mol
Molecular Formula C27H54O
Exact Mass 394.417466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWeIAdOF1Ul
Name Heptacosanone
CAS Registry Number 7796-19-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H54O
InChI InChI=1S/C27H54O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(2)28/h3-26H2,1-2H3
InChIKey MJEFMWGOVVCQIK-UHFFFAOYSA-N
Molecular Weight 394.728 g/mol
SMILES C(=O)(CCCCCCCCCCCCCCCCCCCCCCCCC)C
SPLASH splash10-00fu-9410000000-a939be56cc5aefb6fd7c
Source of Spectrum Y1-41-1063-4
Synonyms 2-Heptacosanone Heptacosan-2-one
Wiley ID 1564962