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3-Octadecanone
SpectraBase Compound ID 6m5t3KzodDB
InChI InChI=1S/C18H36O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)4-2/h3-17H2,1-2H3
InChIKey LMCGARAPKXJPNG-UHFFFAOYSA-N
Mol Weight 268.5 g/mol
Molecular Formula C18H36O
Exact Mass 268.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EvLitgpN2H
Name 3-Octadecanone
Alternate Name(s) Octadecan-3-one Ethyl pentadecyl ketone
CAS Registry Number 18261-92-2
Comments Expert review - structure and names changed
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O
InChI InChI=1S/C18H36O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)4-2/h3-17H2,1-2H3
InChIKey LMCGARAPKXJPNG-UHFFFAOYSA-N
Molecular Weight 268.485 g/mol
SMILES CCC(CCCCCCCCCCCCCCC)=O
SPLASH splash10-05fr-9010000000-a4a634283b0f1229a161
Wiley ID 1510045