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Eicosane, 9-octyl-
SpectraBase Compound ID 5X8u3BG2mYL
InChI InChI=1S/C28H58/c1-4-7-10-13-16-17-18-21-24-27-28(25-22-19-14-11-8-5-2)26-23-20-15-12-9-6-3/h28H,4-27H2,1-3H3
InChIKey JNRMADFNKDCLKT-UHFFFAOYSA-N
Mol Weight 394.8 g/mol
Molecular Formula C28H58
Exact Mass 394.453852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ll9bldVTC6Y
Name Eicosane, 9-octyl-
Alternate Name(s) 9-Octylicosane 9-nor-octyleicosane 9-n-Octyleicosane 9-Octyleicosane
CAS Registry Number 13475-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H58
InChI InChI=1S/C28H58/c1-4-7-10-13-16-17-18-21-24-27-28(25-22-19-14-11-8-5-2)26-23-20-15-12-9-6-3/h28H,4-27H2,1-3H3
InChIKey JNRMADFNKDCLKT-UHFFFAOYSA-N
Molecular Weight 394.772 g/mol
SMILES CCCCCCCCC(CCCCCCCCCCC)CCCCCCCC
SPLASH splash10-0a4l-9010000000-6e272a0ea4c0839710e1
Source of Spectrum AA-0-2150-2
Wiley ID 56647